3-(benzimidazol-1-yl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]propanamide

C19H22N4O2 — CID 131929542

IUPAC3-(benzimidazol-1-yl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]propanamide
SMILESCOc1c(C)cnc(CNC(=O)CCn2cnc3ccccc32)c1C
InChIInChI=1S/C19H22N4O2/c1-13-10-20-16(14(2)19(13)25-3)11-21-18(24)8-9-23-12-22-15-6-4-5-7-17(15)23/h4-7,10,12H,8-9,11H2,1-3H3,(H,21,24)
InChIKeySWKDKJYIOWVIEC-UHFFFAOYSA-N
MW338.41 g/mol
LogP2.76
Rot. Bonds6

About 3-(benzimidazol-1-yl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]propanamide

3-(benzimidazol-1-yl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]propanamide (PubChem CID 131929542) has the molecular formula C19H22N4O2 and a molecular weight of 338.41 g/mol. Its IUPAC name is 3-(benzimidazol-1-yl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]propanamide.

Molecular Properties

Compound Name3-(benzimidazol-1-yl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]propanamide
PubChem CID131929542
Molecular FormulaC19H22N4O2
Molecular Weight338.41 g/mol
Exact Mass338.17
IUPAC Name3-(benzimidazol-1-yl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]propanamide
SMILESCOc1c(C)cnc(CNC(=O)CCn2cnc3ccccc32)c1C
InChIInChI=1S/C19H22N4O2/c1-13-10-20-16(14(2)19(13)25-3)11-21-18(24)8-9-23-12-22-15-6-4-5-7-17(15)23/h4-7,10,12H,8-9,11H2,1-3H3,(H,21,24)
InChIKeySWKDKJYIOWVIEC-UHFFFAOYSA-N
XLogP2.76
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-(benzimidazol-1-yl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]propanamide 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

3-(benzimidazol-1-yl)-N-[(5,6-dimethyl-3-pyridinyl)methyl]propanamide
CID 131919105
3-(benzimidazol-1-yl)-N-benzylpropanamide
CID 4972644
3-(benzimidazol-1-yl)-N-(2-methoxyethyl)propanamide
CID 36838359
3-(benzimidazol-1-yl)-N-[(5-methyl-1H-pyrazol-4-yl)methyl]propanamide
CID 61004748
3-(benzimidazol-1-yl)-N-[(3-methylphenyl)methyl]propanamide
CID 34166297
3-(benzimidazol-1-yl)-N-[(5-methoxy-1H-indol-2-yl)methyl]propanamide
CID 91795395
N-[2-(benzimidazol-1-yl)ethyl]butanamide
CID 47404733
3-(benzimidazol-1-yl)-N-[2-(methylamino)propyl]propanamide
CID 120827403
methyl 2-[3-(benzimidazol-1-yl)propanoylamino]propanoate
CID 60675736
3-(benzimidazol-1-yl)-N-(2-hydroxy-2-methylbutyl)propanamide
CID 65114475
3-(benzimidazol-1-yl)-N-(3,4-dimethoxyphenyl)propanamide
CID 36842808
3-(benzimidazol-1-yl)-N-[2-(1H-pyrazol-4-yl)ethyl]propanamide
CID 77092597

Frequently Asked Questions

What is the IUPAC name of 3-(benzimidazol-1-yl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]propanamide?
The IUPAC name of 3-(benzimidazol-1-yl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]propanamide (CID 131929542) is 3-(benzimidazol-1-yl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]propanamide.
What is the SMILES notation for 3-(benzimidazol-1-yl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]propanamide?
The canonical SMILES for 3-(benzimidazol-1-yl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]propanamide is COc1c(C)cnc(CNC(=O)CCn2cnc3ccccc32)c1C.
What is the InChIKey of 3-(benzimidazol-1-yl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]propanamide?
The InChIKey is SWKDKJYIOWVIEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O2/c1-13-10-20-16(14(2)19(13)25-3)11-21-18(24)8-9-23-12-22-15-6-4-5-7-17(15)23/h4-7,10,12H,8-9,11H2,1-3H3,(H,21,24).
What are the key properties of 3-(benzimidazol-1-yl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]propanamide?
3-(benzimidazol-1-yl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]propanamide has a molecular weight of 338.41 g/mol, XLogP of 2.76, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(benzimidazol-1-yl)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]propanamide is sourced from PubChem (CID 131929542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).