N,N-dibenzyl-1,2-dimethylbenzimidazole-5-carboxamide

C24H23N3O — CID 100776245

IUPACN,N-dibenzyl-1,2-dimethylbenzimidazole-5-carboxamide
SMILESCc1nc2cc(C(=O)N(Cc3ccccc3)Cc3ccccc3)ccc2n1C
InChIInChI=1S/C24H23N3O/c1-18-25-22-15-21(13-14-23(22)26(18)2)24(28)27(16-19-9-5-3-6-10-19)17-20-11-7-4-8-12-20/h3-15H,16-17H2,1-2H3
InChIKeyHKDILURCBGBMNW-UHFFFAOYSA-N
MW369.47 g/mol
LogP4.72
Rot. Bonds5

About N,N-dibenzyl-1,2-dimethylbenzimidazole-5-carboxamide

N,N-dibenzyl-1,2-dimethylbenzimidazole-5-carboxamide (PubChem CID 100776245) has the molecular formula C24H23N3O and a molecular weight of 369.47 g/mol. Its IUPAC name is N,N-dibenzyl-1,2-dimethylbenzimidazole-5-carboxamide.

Molecular Properties

Compound NameN,N-dibenzyl-1,2-dimethylbenzimidazole-5-carboxamide
PubChem CID100776245
Molecular FormulaC24H23N3O
Molecular Weight369.47 g/mol
Exact Mass369.18
IUPAC NameN,N-dibenzyl-1,2-dimethylbenzimidazole-5-carboxamide
SMILESCc1nc2cc(C(=O)N(Cc3ccccc3)Cc3ccccc3)ccc2n1C
InChIInChI=1S/C24H23N3O/c1-18-25-22-15-21(13-14-23(22)26(18)2)24(28)27(16-19-9-5-3-6-10-19)17-20-11-7-4-8-12-20/h3-15H,16-17H2,1-2H3
InChIKeyHKDILURCBGBMNW-UHFFFAOYSA-N
XLogP4.72
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.47
LogP ≤ 54.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-N-ethyl-1-methylbenzimidazole-5-carboxamide
CID 110692583
1,2-dimethyl-N-phenylbenzimidazole-5-carboxamide
CID 110765831
1-benzyl-3-[(1,2-dimethylbenzimidazol-5-yl)methyl]urea
CID 110775488
N-benzyl-2-cyclopropyl-N,1-dimethylbenzimidazole-5-carboxamide
CID 110766019
N,1,2-trimethyl-N-(2-pyridin-4-ylethyl)benzimidazole-5-carboxamide
CID 110765803
[4-(1,2-dimethylbenzimidazole-5-carbonyl)piperazin-1-yl]-phenylmethanone
CID 110802064
2-chloro-1-(1,2-dimethylbenzimidazol-5-yl)ethanone
CID 39104493
2-[(3-fluorophenyl)methyl-(2-methyl-1-phenylbenzimidazole-5-carbonyl)amino]acetic acid
CID 110165667
2-(1,2-dimethylbenzimidazol-5-yl)ethylcarbamic acid
CID 115171173
3-[(1,2-dimethylbenzimidazole-5-carbonyl)-pyridin-2-ylamino]-2-methylpropanoic acid
CID 129259706
2-[(1-ethyl-2-methylbenzimidazole-5-carbonyl)-[(4-fluorophenyl)methyl]amino]acetic acid
CID 110165516
3-(1,2-dimethylbenzimidazol-5-yl)-2-methyl-3-oxopropanoic acid
CID 116918248

Frequently Asked Questions

What is the IUPAC name of N,N-dibenzyl-1,2-dimethylbenzimidazole-5-carboxamide?
The IUPAC name of N,N-dibenzyl-1,2-dimethylbenzimidazole-5-carboxamide (CID 100776245) is N,N-dibenzyl-1,2-dimethylbenzimidazole-5-carboxamide.
What is the SMILES notation for N,N-dibenzyl-1,2-dimethylbenzimidazole-5-carboxamide?
The canonical SMILES for N,N-dibenzyl-1,2-dimethylbenzimidazole-5-carboxamide is Cc1nc2cc(C(=O)N(Cc3ccccc3)Cc3ccccc3)ccc2n1C.
What is the InChIKey of N,N-dibenzyl-1,2-dimethylbenzimidazole-5-carboxamide?
The InChIKey is HKDILURCBGBMNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3O/c1-18-25-22-15-21(13-14-23(22)26(18)2)24(28)27(16-19-9-5-3-6-10-19)17-20-11-7-4-8-12-20/h3-15H,16-17H2,1-2H3.
What are the key properties of N,N-dibenzyl-1,2-dimethylbenzimidazole-5-carboxamide?
N,N-dibenzyl-1,2-dimethylbenzimidazole-5-carboxamide has a molecular weight of 369.47 g/mol, XLogP of 4.72, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibenzyl-1,2-dimethylbenzimidazole-5-carboxamide is sourced from PubChem (CID 100776245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).