N3X

~{N}-[(1-methylindazol-6-yl)methyl]propanamide

Created:	2022-08-11
Last modified:	2024-09-27

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1 entries where N3X is covalently linked to polymer or other heterogen groups

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Chemical Details
Formal Charge	0
Atom Count	31
Chiral Atom Count	0
Bond Count	32
Aromatic Bond Count	10

2D diagram of N3X

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Chemical Component Summary
Name	~{N}-[(1-methylindazol-6-yl)methyl]propanamide
Systematic Name (OpenEye OEToolkits)	~{N}-[(1-methylindazol-6-yl)methyl]propanamide
Formula	C₁₂ H₁₅ N₃ O
Molecular Weight	217.267
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	CCC(=O)NCc1ccc2cnn(C)c2c1
SMILES	OpenEye OEToolkits	2.0.7	CCC(=O)NCc1ccc2cnn(c2c1)C
Canonical SMILES	CACTVS	3.385	CCC(=O)NCc1ccc2cnn(C)c2c1
Canonical SMILES	OpenEye OEToolkits	2.0.7	CCC(=O)NCc1ccc2cnn(c2c1)C
InChI	InChI	1.06	InChI=1S/C12H15N3O/c1-3-12(16)13-7-9-4-5-10-8-14-15(2)11(10)6-9/h4-6,8H,3,7H2,1-2H3,(H,13,16)
InChIKey	InChI	1.06	BEDCFWJZXJLEPB-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	165111565

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