LFM

N-[(4-fluorophenyl)methyl]-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-3-carboxamide

Created:	2019-02-22
Last modified:	2019-05-08

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1 entries where LFM is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	34
Chiral Atom Count	0
Bond Count	36
Aromatic Bond Count	11

2D diagram of LFM

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Chemical Component Summary
Name	N-[(4-fluorophenyl)methyl]-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine-3-carboxamide
Systematic Name (OpenEye OEToolkits)	~{N}-[(4-fluorophenyl)methyl]-6,7-dihydro-5~{H}-pyrazolo[5,1-b][1,3]oxazine-3-carboxamide
Formula	C₁₄ H₁₄ F N₃ O₂
Molecular Weight	275.278
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	N(Cc1ccc(F)cc1)C(=O)c2cnn3c2OCCC3
SMILES	CACTVS	3.385	Fc1ccc(CNC(=O)c2cnn3CCCOc23)cc1
SMILES	OpenEye OEToolkits	2.0.6	c1cc(ccc1CNC(=O)c2cnn3c2OCCC3)F
Canonical SMILES	CACTVS	3.385	Fc1ccc(CNC(=O)c2cnn3CCCOc23)cc1
Canonical SMILES	OpenEye OEToolkits	2.0.6	c1cc(ccc1CNC(=O)c2cnn3c2OCCC3)F
InChI	InChI	1.03	InChI=1S/C14H14FN3O2/c15-11-4-2-10(3-5-11)8-16-13(19)12-9-17-18-6-1-7-20-14(12)18/h2-5,9H,1,6-8H2,(H,16,19)
InChIKey	InChI	1.03	GWOXVNOLEPNQGX-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	90537080

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