6-[[2-(dimethylamino)acetyl]amino]-N-(2-pyridin-2-yl-3H-benzimidazol-5-yl)pyridine-3-carboxamide

C22H21N7O2 — CID 143254703

IUPAC6-[[2-(dimethylamino)acetyl]amino]-N-(2-pyridin-2-yl-3H-benzimidazol-5-yl)pyridine-3-carboxamide
SMILESCN(C)CC(=O)Nc1ccc(C(=O)Nc2ccc3nc(-c4ccccn4)[nH]c3c2)cn1
InChIInChI=1S/C22H21N7O2/c1-29(2)13-20(30)28-19-9-6-14(12-24-19)22(31)25-15-7-8-16-18(11-15)27-21(26-16)17-5-3-4-10-23-17/h3-12H,13H2,1-2H3,(H,25,31)(H,26,27)(H,24,28,30)
InChIKeyUFSYHVFZUGGOCG-UHFFFAOYSA-N
MW415.46 g/mol
LogP2.77
Rot. Bonds6

About 6-[[2-(dimethylamino)acetyl]amino]-N-(2-pyridin-2-yl-3H-benzimidazol-5-yl)pyridine-3-carboxamide

6-[[2-(dimethylamino)acetyl]amino]-N-(2-pyridin-2-yl-3H-benzimidazol-5-yl)pyridine-3-carboxamide (PubChem CID 143254703) has the molecular formula C22H21N7O2 and a molecular weight of 415.46 g/mol. Its IUPAC name is 6-[[2-(dimethylamino)acetyl]amino]-N-(2-pyridin-2-yl-3H-benzimidazol-5-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[[2-(dimethylamino)acetyl]amino]-N-(2-pyridin-2-yl-3H-benzimidazol-5-yl)pyridine-3-carboxamide
PubChem CID143254703
Molecular FormulaC22H21N7O2
Molecular Weight415.46 g/mol
Exact Mass415.18
IUPAC Name6-[[2-(dimethylamino)acetyl]amino]-N-(2-pyridin-2-yl-3H-benzimidazol-5-yl)pyridine-3-carboxamide
SMILESCN(C)CC(=O)Nc1ccc(C(=O)Nc2ccc3nc(-c4ccccn4)[nH]c3c2)cn1
InChIInChI=1S/C22H21N7O2/c1-29(2)13-20(30)28-19-9-6-14(12-24-19)22(31)25-15-7-8-16-18(11-15)27-21(26-16)17-5-3-4-10-23-17/h3-12H,13H2,1-2H3,(H,25,31)(H,26,27)(H,24,28,30)
InChIKeyUFSYHVFZUGGOCG-UHFFFAOYSA-N
XLogP2.77
TPSA115.90 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.46
LogP ≤ 52.77
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 6-[[2-(dimethylamino)acetyl]amino]-N-(2-pyridin-2-yl-3H-benzimidazol-5-yl)pyridine-3-carboxamide with MolForge

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Related Compounds

N-(2-pyridin-2-yl-3H-benzimidazol-5-yl)pyridine-4-carboxamide
CID 53368586
3-fluoro-N-(2-pyridin-2-yl-3H-benzimidazol-5-yl)benzamide
CID 56762590
2-methoxy-N-(2-pyridin-2-yl-3H-benzimidazol-5-yl)acetamide
CID 56762292
1-methyl-N-(2-pyridin-2-yl-3H-benzimidazol-5-yl)imidazole-4-carboxamide
CID 122156351
2-pyridin-2-yl-3H-benzimidazole-5-carboxylate
CID 7044978
N-(4-chloro-3-pyridin-2-ylphenyl)-6-[2-(dimethylamino)ethylamino]pyridine-3-carboxamide
CID 58614711
N-(2-pyridin-4-yl-3H-benzimidazol-5-yl)benzamide
CID 53371216
N-[2-[4-(methylamino)phenyl]-3H-benzimidazol-5-yl]pyridine-2-carboxamide
CID 142813059
4-[(2-phenylacetyl)amino]-N-[4-[6-[[4-[(2-phenylacetyl)amino]benzoyl]amino]-1H-benzimidazol-2-yl]phenyl]benzamide
CID 2832124
N-[2-(4-benzylphenyl)-3H-benzimidazol-5-yl]-4-(dimethylamino)benzamide
CID 67686397
N-[2-(4-aminophenyl)-3H-benzimidazol-5-yl]pyridine-2-carboxamide
CID 10149852
3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)-N-(2-pyridin-2-yl-3H-benzimidazol-5-yl)propanamide
CID 167789601

Frequently Asked Questions

What is the IUPAC name of 6-[[2-(dimethylamino)acetyl]amino]-N-(2-pyridin-2-yl-3H-benzimidazol-5-yl)pyridine-3-carboxamide?
The IUPAC name of 6-[[2-(dimethylamino)acetyl]amino]-N-(2-pyridin-2-yl-3H-benzimidazol-5-yl)pyridine-3-carboxamide (CID 143254703) is 6-[[2-(dimethylamino)acetyl]amino]-N-(2-pyridin-2-yl-3H-benzimidazol-5-yl)pyridine-3-carboxamide.
What is the SMILES notation for 6-[[2-(dimethylamino)acetyl]amino]-N-(2-pyridin-2-yl-3H-benzimidazol-5-yl)pyridine-3-carboxamide?
The canonical SMILES for 6-[[2-(dimethylamino)acetyl]amino]-N-(2-pyridin-2-yl-3H-benzimidazol-5-yl)pyridine-3-carboxamide is CN(C)CC(=O)Nc1ccc(C(=O)Nc2ccc3nc(-c4ccccn4)[nH]c3c2)cn1.
What is the InChIKey of 6-[[2-(dimethylamino)acetyl]amino]-N-(2-pyridin-2-yl-3H-benzimidazol-5-yl)pyridine-3-carboxamide?
The InChIKey is UFSYHVFZUGGOCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N7O2/c1-29(2)13-20(30)28-19-9-6-14(12-24-19)22(31)25-15-7-8-16-18(11-15)27-21(26-16)17-5-3-4-10-23-17/h3-12H,13H2,1-2H3,(H,25,31)(H,26,27)(H,24,28,30).
What are the key properties of 6-[[2-(dimethylamino)acetyl]amino]-N-(2-pyridin-2-yl-3H-benzimidazol-5-yl)pyridine-3-carboxamide?
6-[[2-(dimethylamino)acetyl]amino]-N-(2-pyridin-2-yl-3H-benzimidazol-5-yl)pyridine-3-carboxamide has a molecular weight of 415.46 g/mol, XLogP of 2.77, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[2-(dimethylamino)acetyl]amino]-N-(2-pyridin-2-yl-3H-benzimidazol-5-yl)pyridine-3-carboxamide is sourced from PubChem (CID 143254703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).