N-(2-ethyl-1-methylbenzimidazol-5-yl)-4-pyridin-4-ylbutanamide

C19H22N4O — CID 46964209

IUPACN-(2-ethyl-1-methylbenzimidazol-5-yl)-4-pyridin-4-ylbutanamide
SMILESCCc1nc2cc(NC(=O)CCCc3ccncc3)ccc2n1C
InChIInChI=1S/C19H22N4O/c1-3-18-22-16-13-15(7-8-17(16)23(18)2)21-19(24)6-4-5-14-9-11-20-12-10-14/h7-13H,3-6H2,1-2H3,(H,21,24)
InChIKeyJJDVGMARYKGNDA-UHFFFAOYSA-N
MW322.41 g/mol
LogP3.49
Rot. Bonds6

About N-(2-ethyl-1-methylbenzimidazol-5-yl)-4-pyridin-4-ylbutanamide

N-(2-ethyl-1-methylbenzimidazol-5-yl)-4-pyridin-4-ylbutanamide (PubChem CID 46964209) has the molecular formula C19H22N4O and a molecular weight of 322.41 g/mol. Its IUPAC name is N-(2-ethyl-1-methylbenzimidazol-5-yl)-4-pyridin-4-ylbutanamide.

Molecular Properties

Compound NameN-(2-ethyl-1-methylbenzimidazol-5-yl)-4-pyridin-4-ylbutanamide
PubChem CID46964209
Molecular FormulaC19H22N4O
Molecular Weight322.41 g/mol
Exact Mass322.18
IUPAC NameN-(2-ethyl-1-methylbenzimidazol-5-yl)-4-pyridin-4-ylbutanamide
SMILESCCc1nc2cc(NC(=O)CCCc3ccncc3)ccc2n1C
InChIInChI=1S/C19H22N4O/c1-3-18-22-16-13-15(7-8-17(16)23(18)2)21-19(24)6-4-5-14-9-11-20-12-10-14/h7-13H,3-6H2,1-2H3,(H,21,24)
InChIKeyJJDVGMARYKGNDA-UHFFFAOYSA-N
XLogP3.49
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(2-ethyl-1-methylbenzimidazol-5-yl)-4-pyridin-4-ylbutanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[1-methyl-2-[2-(2-oxo-1-pyridinyl)ethyl]benzimidazol-5-yl]pentanamide
CID 17244491
N-(2-methyl-1-propylbenzimidazol-5-yl)-3-pyridin-4-ylpropanamide
CID 131927243
N-[2-[1-methyl-5-(pentanoylamino)benzimidazol-2-yl]ethyl]cyclopropanecarboxamide
CID 46270443
N-[1-methyl-2-(2-piperidin-1-ylethyl)benzimidazol-5-yl]butanamide
CID 4889006
N-[1-methyl-2-[2-(2-oxopiperidin-1-yl)ethyl]benzimidazol-5-yl]pentanamide
CID 17218670
N-(1,2-dimethylbenzimidazol-5-yl)butanamide
CID 965373
N-[1-methyl-2-[[methyl(propan-2-ylcarbamoyl)amino]methyl]benzimidazol-5-yl]-3-phenylpropanamide
CID 52901844
N-[2-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-1-methylbenzimidazol-5-yl]butanamide
CID 17218644
N-[1-methyl-2-(2-phenylethyl)benzimidazol-5-yl]-2-phenylsulfanylacetamide
CID 46328935
N-[1-methyl-2-[2-(4-methylpiperidin-1-yl)ethyl]benzimidazol-5-yl]butanamide
CID 4972904
N-[1-methyl-2-[2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]benzimidazol-5-yl]butanamide
CID 7011906
N-[1-methyl-2-(2-phenylethyl)benzimidazol-5-yl]benzamide
CID 46328940

Frequently Asked Questions

What is the IUPAC name of N-(2-ethyl-1-methylbenzimidazol-5-yl)-4-pyridin-4-ylbutanamide?
The IUPAC name of N-(2-ethyl-1-methylbenzimidazol-5-yl)-4-pyridin-4-ylbutanamide (CID 46964209) is N-(2-ethyl-1-methylbenzimidazol-5-yl)-4-pyridin-4-ylbutanamide.
What is the SMILES notation for N-(2-ethyl-1-methylbenzimidazol-5-yl)-4-pyridin-4-ylbutanamide?
The canonical SMILES for N-(2-ethyl-1-methylbenzimidazol-5-yl)-4-pyridin-4-ylbutanamide is CCc1nc2cc(NC(=O)CCCc3ccncc3)ccc2n1C.
What is the InChIKey of N-(2-ethyl-1-methylbenzimidazol-5-yl)-4-pyridin-4-ylbutanamide?
The InChIKey is JJDVGMARYKGNDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O/c1-3-18-22-16-13-15(7-8-17(16)23(18)2)21-19(24)6-4-5-14-9-11-20-12-10-14/h7-13H,3-6H2,1-2H3,(H,21,24).
What are the key properties of N-(2-ethyl-1-methylbenzimidazol-5-yl)-4-pyridin-4-ylbutanamide?
N-(2-ethyl-1-methylbenzimidazol-5-yl)-4-pyridin-4-ylbutanamide has a molecular weight of 322.41 g/mol, XLogP of 3.49, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethyl-1-methylbenzimidazol-5-yl)-4-pyridin-4-ylbutanamide is sourced from PubChem (CID 46964209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).