2-acetyl-N-[(1S)-1-(1-methylbenzimidazol-2-yl)ethyl]benzamide

C19H19N3O2 — CID 124608305

IUPAC2-acetyl-N-[(1S)-1-(1-methylbenzimidazol-2-yl)ethyl]benzamide
SMILESCC(=O)c1ccccc1C(=O)N[C@@H](C)c1nc2ccccc2n1C
InChIInChI=1S/C19H19N3O2/c1-12(18-21-16-10-6-7-11-17(16)22(18)3)20-19(24)15-9-5-4-8-14(15)13(2)23/h4-12H,1-3H3,(H,20,24)/t12-/m0/s1
InChIKeyJGWDDZLDERYCEJ-LBPRGKRZSA-N
MW321.38 g/mol
LogP3.27
Rot. Bonds4

About 2-acetyl-N-[(1S)-1-(1-methylbenzimidazol-2-yl)ethyl]benzamide

2-acetyl-N-[(1S)-1-(1-methylbenzimidazol-2-yl)ethyl]benzamide (PubChem CID 124608305) has the molecular formula C19H19N3O2 and a molecular weight of 321.38 g/mol. Its IUPAC name is 2-acetyl-N-[(1S)-1-(1-methylbenzimidazol-2-yl)ethyl]benzamide.

Molecular Properties

Compound Name2-acetyl-N-[(1S)-1-(1-methylbenzimidazol-2-yl)ethyl]benzamide
PubChem CID124608305
Molecular FormulaC19H19N3O2
Molecular Weight321.38 g/mol
Exact Mass321.15
IUPAC Name2-acetyl-N-[(1S)-1-(1-methylbenzimidazol-2-yl)ethyl]benzamide
SMILESCC(=O)c1ccccc1C(=O)N[C@@H](C)c1nc2ccccc2n1C
InChIInChI=1S/C19H19N3O2/c1-12(18-21-16-10-6-7-11-17(16)22(18)3)20-19(24)15-9-5-4-8-14(15)13(2)23/h4-12H,1-3H3,(H,20,24)/t12-/m0/s1
InChIKeyJGWDDZLDERYCEJ-LBPRGKRZSA-N
XLogP3.27
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-acetyl-N-[(1S)-1-(1-methylbenzimidazol-2-yl)ethyl]benzamide 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

2,4-dimethyl-N-[1-(1-methylbenzimidazol-2-yl)ethyl]benzamide
CID 16967777
N-[(1R)-1-(1-methylbenzimidazol-2-yl)ethyl]-2-pyrrolidin-1-ylpyridine-3-carboxamide
CID 95772183
N-[(1S)-1-(1-methylbenzimidazol-2-yl)ethyl]propanamide
CID 751102
N-[1-(1-methylbenzimidazol-2-yl)ethyl]pyridine-2-carboxamide
CID 16966659
4-fluoro-N-[(1R)-1-(1-methylbenzimidazol-2-yl)ethyl]benzamide
CID 751122
N-[(1R)-1-(1-methylbenzimidazol-2-yl)ethyl]-2-piperidin-1-ylsulfonylbenzamide
CID 95772173
2,2-dimethyl-N-[(1S)-1-(1-methylbenzimidazol-2-yl)ethyl]propanamide
CID 751106
(2S)-2-amino-3,3-dimethyl-N-[1-(1-methylbenzimidazol-2-yl)ethyl]butanamide
CID 119890012
N-[(1S)-1-(1-methylbenzimidazol-2-yl)ethyl]-2-phenylacetamide
CID 751118
N-[1-(1-methylbenzimidazol-2-yl)ethyl]-2-phenylacetamide
CID 4082682
2-methoxy-N-[(1R)-1-(1-methylbenzimidazol-2-yl)ethyl]acetamide
CID 751110
2-methoxy-N-[2-methyl-1-(1-methylbenzimidazol-2-yl)propyl]benzamide
CID 121240654

Frequently Asked Questions

What is the IUPAC name of 2-acetyl-N-[(1S)-1-(1-methylbenzimidazol-2-yl)ethyl]benzamide?
The IUPAC name of 2-acetyl-N-[(1S)-1-(1-methylbenzimidazol-2-yl)ethyl]benzamide (CID 124608305) is 2-acetyl-N-[(1S)-1-(1-methylbenzimidazol-2-yl)ethyl]benzamide.
What is the SMILES notation for 2-acetyl-N-[(1S)-1-(1-methylbenzimidazol-2-yl)ethyl]benzamide?
The canonical SMILES for 2-acetyl-N-[(1S)-1-(1-methylbenzimidazol-2-yl)ethyl]benzamide is CC(=O)c1ccccc1C(=O)N[C@@H](C)c1nc2ccccc2n1C.
What is the InChIKey of 2-acetyl-N-[(1S)-1-(1-methylbenzimidazol-2-yl)ethyl]benzamide?
The InChIKey is JGWDDZLDERYCEJ-LBPRGKRZSA-N. The full InChI is InChI=1S/C19H19N3O2/c1-12(18-21-16-10-6-7-11-17(16)22(18)3)20-19(24)15-9-5-4-8-14(15)13(2)23/h4-12H,1-3H3,(H,20,24)/t12-/m0/s1.
What are the key properties of 2-acetyl-N-[(1S)-1-(1-methylbenzimidazol-2-yl)ethyl]benzamide?
2-acetyl-N-[(1S)-1-(1-methylbenzimidazol-2-yl)ethyl]benzamide has a molecular weight of 321.38 g/mol, XLogP of 3.27, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetyl-N-[(1S)-1-(1-methylbenzimidazol-2-yl)ethyl]benzamide is sourced from PubChem (CID 124608305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).