ZVB
2-(propan-2-yl)-1H-pyrrolo[3,2-b]pyridine
Created: | 2023-07-05 |
Last modified: | 2023-07-26 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 24 |
Chiral Atom Count | 0 |
Bond Count | 25 |
Aromatic Bond Count | 10 |
Chemical Component Summary | |
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Name | 2-(propan-2-yl)-1H-pyrrolo[3,2-b]pyridine |
Systematic Name (OpenEye OEToolkits) | 2-propan-2-yl-1~{H}-pyrrolo[3,2-b]pyridine |
Formula | C10 H12 N2 |
Molecular Weight | 160.216 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | CC(C)c1cc2ncccc2[NH]1 |
SMILES | CACTVS | 3.385 | CC(C)c1[nH]c2cccnc2c1 |
SMILES | OpenEye OEToolkits | 2.0.7 | CC(C)c1cc2c([nH]1)cccn2 |
Canonical SMILES | CACTVS | 3.385 | CC(C)c1[nH]c2cccnc2c1 |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | CC(C)c1cc2c([nH]1)cccn2 |
InChI | InChI | 1.06 | InChI=1S/C10H12N2/c1-7(2)9-6-10-8(12-9)4-3-5-11-10/h3-7,12H,1-2H3 |
InChIKey | InChI | 1.06 | OKEHFANNANVSEO-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 12570390 |