5-amino-N-(1H-benzimidazol-2-yl)pyridine-2-carboxamide

C13H11N5O — CID 81316691

IUPAC5-amino-N-(1H-benzimidazol-2-yl)pyridine-2-carboxamide
SMILESNc1ccc(C(=O)Nc2nc3ccccc3[nH]2)nc1
InChIInChI=1S/C13H11N5O/c14-8-5-6-11(15-7-8)12(19)18-13-16-9-3-1-2-4-10(9)17-13/h1-7H,14H2,(H2,16,17,18,19)
InChIKeyYBPVROCRWRGJOQ-UHFFFAOYSA-N
MW253.27 g/mol
LogP1.79
Rot. Bonds2

About 5-amino-N-(1H-benzimidazol-2-yl)pyridine-2-carboxamide

5-amino-N-(1H-benzimidazol-2-yl)pyridine-2-carboxamide (PubChem CID 81316691) has the molecular formula C13H11N5O and a molecular weight of 253.27 g/mol. Its IUPAC name is 5-amino-N-(1H-benzimidazol-2-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-amino-N-(1H-benzimidazol-2-yl)pyridine-2-carboxamide
PubChem CID81316691
Molecular FormulaC13H11N5O
Molecular Weight253.27 g/mol
Exact Mass253.10
IUPAC Name5-amino-N-(1H-benzimidazol-2-yl)pyridine-2-carboxamide
SMILESNc1ccc(C(=O)Nc2nc3ccccc3[nH]2)nc1
InChIInChI=1S/C13H11N5O/c14-8-5-6-11(15-7-8)12(19)18-13-16-9-3-1-2-4-10(9)17-13/h1-7H,14H2,(H2,16,17,18,19)
InChIKeyYBPVROCRWRGJOQ-UHFFFAOYSA-N
XLogP1.79
TPSA96.69 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.27
LogP ≤ 51.79
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-N-(1H-benzimidazol-2-yl)benzamide
CID 62060005
N-(1H-benzimidazol-2-yl)-1H-benzimidazole-2-carboxamide
CID 12620222
N-(1H-benzimidazol-2-yl)-4-hydrazinylpyridine-2-carboxamide
CID 63563951
2-amino-N-(1H-benzimidazol-2-yl)pyridine-4-carboxamide
CID 63565075
2-amino-N-(1H-benzimidazol-2-yl)-6-chloropyridine-4-carboxamide
CID 62873677
3-amino-N-(1H-benzimidazol-2-yl)-4,5-dichlorobenzamide
CID 63565379
N-(1H-benzimidazol-2-yl)-2-hydrazinylpyridine-3-carboxamide
CID 63563952
2-amino-N-(1H-benzimidazol-2-yl)-3-fluoropyridine-4-carboxamide
CID 105386285
N-(1H-benzimidazol-2-yl)-5-bromo-2-hydrazinylpyridine-3-carboxamide
CID 63565103
N-(1H-benzimidazol-2-yl)pyridine-4-carboxamide
CID 896334
2-amino-N-(1H-benzimidazol-2-yl)-3-fluorobenzamide
CID 63565257
N-(1H-benzimidazol-2-yl)-2-fluorobenzamide
CID 2166675

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(1H-benzimidazol-2-yl)pyridine-2-carboxamide?
The IUPAC name of 5-amino-N-(1H-benzimidazol-2-yl)pyridine-2-carboxamide (CID 81316691) is 5-amino-N-(1H-benzimidazol-2-yl)pyridine-2-carboxamide.
What is the SMILES notation for 5-amino-N-(1H-benzimidazol-2-yl)pyridine-2-carboxamide?
The canonical SMILES for 5-amino-N-(1H-benzimidazol-2-yl)pyridine-2-carboxamide is Nc1ccc(C(=O)Nc2nc3ccccc3[nH]2)nc1.
What is the InChIKey of 5-amino-N-(1H-benzimidazol-2-yl)pyridine-2-carboxamide?
The InChIKey is YBPVROCRWRGJOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N5O/c14-8-5-6-11(15-7-8)12(19)18-13-16-9-3-1-2-4-10(9)17-13/h1-7H,14H2,(H2,16,17,18,19).
What are the key properties of 5-amino-N-(1H-benzimidazol-2-yl)pyridine-2-carboxamide?
5-amino-N-(1H-benzimidazol-2-yl)pyridine-2-carboxamide has a molecular weight of 253.27 g/mol, XLogP of 1.79, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-(1H-benzimidazol-2-yl)pyridine-2-carboxamide is sourced from PubChem (CID 81316691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).