2,4-dimethoxy-N-[4-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]benzamide

C25H25N3O3 — CID 46290657

IUPAC2,4-dimethoxy-N-[4-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]benzamide
SMILESCOc1ccc(C(=O)Nc2ccc(CCc3nc4ccccc4n3C)cc2)c(OC)c1
InChIInChI=1S/C25H25N3O3/c1-28-22-7-5-4-6-21(22)27-24(28)15-10-17-8-11-18(12-9-17)26-25(29)20-14-13-19(30-2)16-23(20)31-3/h4-9,11-14,16H,10,15H2,1-3H3,(H,26,29)
InChIKeyBOSMJAQPUVLKAL-UHFFFAOYSA-N
MW415.49 g/mol
LogP4.63
Rot. Bonds7

About 2,4-dimethoxy-N-[4-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]benzamide

2,4-dimethoxy-N-[4-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]benzamide (PubChem CID 46290657) has the molecular formula C25H25N3O3 and a molecular weight of 415.49 g/mol. Its IUPAC name is 2,4-dimethoxy-N-[4-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]benzamide.

Molecular Properties

Compound Name2,4-dimethoxy-N-[4-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]benzamide
PubChem CID46290657
Molecular FormulaC25H25N3O3
Molecular Weight415.49 g/mol
Exact Mass415.19
IUPAC Name2,4-dimethoxy-N-[4-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]benzamide
SMILESCOc1ccc(C(=O)Nc2ccc(CCc3nc4ccccc4n3C)cc2)c(OC)c1
InChIInChI=1S/C25H25N3O3/c1-28-22-7-5-4-6-21(22)27-24(28)15-10-17-8-11-18(12-9-17)26-25(29)20-14-13-19(30-2)16-23(20)31-3/h4-9,11-14,16H,10,15H2,1-3H3,(H,26,29)
InChIKeyBOSMJAQPUVLKAL-UHFFFAOYSA-N
XLogP4.63
TPSA65.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.49
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2,4-dimethoxy-N-[4-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]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

1-[4-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]-3-phenylurea
CID 46382333
1-(5-chloro-2-methoxyphenyl)-3-[4-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]urea
CID 46382338
4-methoxy-N-[1-methyl-2-(2-phenylethyl)benzimidazol-5-yl]benzamide
CID 46328919
1-(3,4-dimethylphenyl)-3-[4-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]urea
CID 50825337
N-[4-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]pyridine-4-carboxamide
CID 46290663
2-(4-methoxyphenyl)-N-[1-methyl-2-(2-phenylethyl)benzimidazol-5-yl]acetamide
CID 46328909
N-[4-[2-(1-ethylbenzimidazol-2-yl)ethyl]phenyl]-3-methoxybenzamide
CID 50765558
2-[3-(4-methoxyphenyl)propyl]-1-methylbenzimidazole
CID 11737586
1-(2-chlorophenyl)-3-[4-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]urea
CID 46382332
2-chloro-N-[3-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]benzamide
CID 46328429
3-(4-methoxyphenyl)-N-[4-[2-(1-phenylbenzimidazol-2-yl)ethyl]phenyl]propanamide
CID 46290493
N-(4-ethoxyphenyl)-2,4-dimethoxybenzamide
CID 669318

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethoxy-N-[4-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]benzamide?
The IUPAC name of 2,4-dimethoxy-N-[4-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]benzamide (CID 46290657) is 2,4-dimethoxy-N-[4-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]benzamide.
What is the SMILES notation for 2,4-dimethoxy-N-[4-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]benzamide?
The canonical SMILES for 2,4-dimethoxy-N-[4-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]benzamide is COc1ccc(C(=O)Nc2ccc(CCc3nc4ccccc4n3C)cc2)c(OC)c1.
What is the InChIKey of 2,4-dimethoxy-N-[4-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]benzamide?
The InChIKey is BOSMJAQPUVLKAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H25N3O3/c1-28-22-7-5-4-6-21(22)27-24(28)15-10-17-8-11-18(12-9-17)26-25(29)20-14-13-19(30-2)16-23(20)31-3/h4-9,11-14,16H,10,15H2,1-3H3,(H,26,29).
What are the key properties of 2,4-dimethoxy-N-[4-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]benzamide?
2,4-dimethoxy-N-[4-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]benzamide has a molecular weight of 415.49 g/mol, XLogP of 4.63, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethoxy-N-[4-[2-(1-methylbenzimidazol-2-yl)ethyl]phenyl]benzamide is sourced from PubChem (CID 46290657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).