N-[3-[(2-chlorophenyl)methyl]-2-propylbenzimidazol-5-yl]acetamide

C19H20ClN3O — CID 22620334

IUPACN-[3-[(2-chlorophenyl)methyl]-2-propylbenzimidazol-5-yl]acetamide
SMILESCCCc1nc2ccc(NC(C)=O)cc2n1Cc1ccccc1Cl
InChIInChI=1S/C19H20ClN3O/c1-3-6-19-22-17-10-9-15(21-13(2)24)11-18(17)23(19)12-14-7-4-5-8-16(14)20/h4-5,7-11H,3,6,12H2,1-2H3,(H,21,24)
InChIKeyOHGJQMHRDUIIBT-UHFFFAOYSA-N
MW341.84 g/mol
LogP4.65
Rot. Bonds5

About N-[3-[(2-chlorophenyl)methyl]-2-propylbenzimidazol-5-yl]acetamide

N-[3-[(2-chlorophenyl)methyl]-2-propylbenzimidazol-5-yl]acetamide (PubChem CID 22620334) has the molecular formula C19H20ClN3O and a molecular weight of 341.84 g/mol. Its IUPAC name is N-[3-[(2-chlorophenyl)methyl]-2-propylbenzimidazol-5-yl]acetamide.

Molecular Properties

Compound NameN-[3-[(2-chlorophenyl)methyl]-2-propylbenzimidazol-5-yl]acetamide
PubChem CID22620334
Molecular FormulaC19H20ClN3O
Molecular Weight341.84 g/mol
Exact Mass341.13
IUPAC NameN-[3-[(2-chlorophenyl)methyl]-2-propylbenzimidazol-5-yl]acetamide
SMILESCCCc1nc2ccc(NC(C)=O)cc2n1Cc1ccccc1Cl
InChIInChI=1S/C19H20ClN3O/c1-3-6-19-22-17-10-9-15(21-13(2)24)11-18(17)23(19)12-14-7-4-5-8-16(14)20/h4-5,7-11H,3,6,12H2,1-2H3,(H,21,24)
InChIKeyOHGJQMHRDUIIBT-UHFFFAOYSA-N
XLogP4.65
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.84
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[3-[(2-chlorophenyl)methyl]-2-propylbenzimidazol-5-yl]acetamide 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-[(2-chlorophenyl)methyl]-2-propylbenzimidazol-5-yl]-piperidin-1-ylmethanone
CID 18315440
1-[2-butyl-3-[(2-chlorophenyl)methyl]benzimidazol-5-yl]-2-methylpropan-1-one
CID 18315589
2-butyl-3-[(2-chlorophenyl)methyl]benzimidazole-5-carboxamide;hydrochloride
CID 139615644
3-[(2-chlorophenyl)methyl]-2-propyl-N-(pyridin-3-ylmethyl)benzimidazole-5-carboxamide
CID 54266313
2-butyl-3-[(2-chlorophenyl)methyl]-N,N-dimethylbenzimidazole-5-carboxamide
CID 18315518
[2-butyl-3-[(2-chlorophenyl)methyl]benzimidazol-5-yl]methanol
CID 19094237
N-(1,3-benzodioxol-5-ylmethyl)-3-[(2-chlorophenyl)methyl]-2-propylbenzimidazole-5-carboxamide
CID 18681073
N-[3-[1-[(2-chlorophenyl)methyl]benzimidazol-2-yl]propyl]butanamide
CID 4754809
1-(2-chlorophenyl)-3-[3-[[4-(2-chlorophenyl)phenyl]methyl]-4-oxo-2-propylquinazolin-6-yl]urea
CID 3188341
N-[2-[1-[(2-chlorophenyl)methyl]benzimidazol-2-yl]ethyl]-2,2-dimethylpropanamide
CID 3160753
N-[[1-[(2-chlorophenyl)methyl]benzimidazol-2-yl]methyl]-2-ethylbutanamide
CID 17006374
6-bromo-2-(2-chloroethyl)-1-[(2-chlorophenyl)methyl]benzimidazole
CID 65345066

Frequently Asked Questions

What is the IUPAC name of N-[3-[(2-chlorophenyl)methyl]-2-propylbenzimidazol-5-yl]acetamide?
The IUPAC name of N-[3-[(2-chlorophenyl)methyl]-2-propylbenzimidazol-5-yl]acetamide (CID 22620334) is N-[3-[(2-chlorophenyl)methyl]-2-propylbenzimidazol-5-yl]acetamide.
What is the SMILES notation for N-[3-[(2-chlorophenyl)methyl]-2-propylbenzimidazol-5-yl]acetamide?
The canonical SMILES for N-[3-[(2-chlorophenyl)methyl]-2-propylbenzimidazol-5-yl]acetamide is CCCc1nc2ccc(NC(C)=O)cc2n1Cc1ccccc1Cl.
What is the InChIKey of N-[3-[(2-chlorophenyl)methyl]-2-propylbenzimidazol-5-yl]acetamide?
The InChIKey is OHGJQMHRDUIIBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20ClN3O/c1-3-6-19-22-17-10-9-15(21-13(2)24)11-18(17)23(19)12-14-7-4-5-8-16(14)20/h4-5,7-11H,3,6,12H2,1-2H3,(H,21,24).
What are the key properties of N-[3-[(2-chlorophenyl)methyl]-2-propylbenzimidazol-5-yl]acetamide?
N-[3-[(2-chlorophenyl)methyl]-2-propylbenzimidazol-5-yl]acetamide has a molecular weight of 341.84 g/mol, XLogP of 4.65, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(2-chlorophenyl)methyl]-2-propylbenzimidazol-5-yl]acetamide is sourced from PubChem (CID 22620334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).