N-[3-[3-(4-methyl-1H-benzimidazol-2-yl)phenyl]phenyl]-1H-imidazole-5-carboxamide

C24H19N5O — CID 44530727

IUPACN-[3-[3-(4-methyl-1H-benzimidazol-2-yl)phenyl]phenyl]-1H-imidazole-5-carboxamide
SMILESCc1cccc2[nH]c(-c3cccc(-c4cccc(NC(=O)c5cnc[nH]5)c4)c3)nc12
InChIInChI=1S/C24H19N5O/c1-15-5-2-10-20-22(15)29-23(28-20)18-8-3-6-16(11-18)17-7-4-9-19(12-17)27-24(30)21-13-25-14-26-21/h2-14H,1H3,(H,25,26)(H,27,30)(H,28,29)
InChIKeyKWJOXVPRQDZMCF-UHFFFAOYSA-N
MW393.45 g/mol
LogP5.18
Rot. Bonds4

About N-[3-[3-(4-methyl-1H-benzimidazol-2-yl)phenyl]phenyl]-1H-imidazole-5-carboxamide

N-[3-[3-(4-methyl-1H-benzimidazol-2-yl)phenyl]phenyl]-1H-imidazole-5-carboxamide (PubChem CID 44530727) has the molecular formula C24H19N5O and a molecular weight of 393.45 g/mol. Its IUPAC name is N-[3-[3-(4-methyl-1H-benzimidazol-2-yl)phenyl]phenyl]-1H-imidazole-5-carboxamide.

Molecular Properties

Compound NameN-[3-[3-(4-methyl-1H-benzimidazol-2-yl)phenyl]phenyl]-1H-imidazole-5-carboxamide
PubChem CID44530727
Molecular FormulaC24H19N5O
Molecular Weight393.45 g/mol
Exact Mass393.16
IUPAC NameN-[3-[3-(4-methyl-1H-benzimidazol-2-yl)phenyl]phenyl]-1H-imidazole-5-carboxamide
SMILESCc1cccc2[nH]c(-c3cccc(-c4cccc(NC(=O)c5cnc[nH]5)c4)c3)nc12
InChIInChI=1S/C24H19N5O/c1-15-5-2-10-20-22(15)29-23(28-20)18-8-3-6-16(11-18)17-7-4-9-19(12-17)27-24(30)21-13-25-14-26-21/h2-14H,1H3,(H,25,26)(H,27,30)(H,28,29)
InChIKeyKWJOXVPRQDZMCF-UHFFFAOYSA-N
XLogP5.18
TPSA86.46 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500393.45
LogP ≤ 55.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 4-[[4-(4-methyl-1H-benzimidazol-2-yl)phenyl]carbamoyl]benzoate
CID 3101729
N-[3-[3-(1H-benzimidazol-2-yl)phenyl]phenyl]-3-methylfuran-2-carboxamide
CID 44530614
N-[4-[3-(4-methyl-1H-benzimidazol-2-yl)phenyl]phenyl]-2-(4-methylpiperazin-1-yl)acetamide
CID 44530774
3-acetamido-N-[3-[3-(1H-benzimidazol-2-yl)phenyl]phenyl]benzamide
CID 44523579
2-methyl-N-(3-pyrimidin-5-ylphenyl)-1H-imidazole-5-carboxamide
CID 110467649
N-[3-(1H-benzimidazol-2-yl)phenyl]-3,5-dimethylbenzamide
CID 969400
1-[3-[5-(4-methyl-1H-benzimidazol-2-yl)thiophen-2-yl]phenyl]-3-thiophen-3-ylurea
CID 44525388
N-[3-(1H-benzimidazol-2-yl)phenyl]-4-methoxybenzamide
CID 2810335
N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]-1H-indole-2-carboxamide
CID 26312296
2-(3-chloro-4-methylphenyl)-4-methyl-1H-benzimidazole
CID 64722904
N-[3-(1H-benzimidazol-2-yl)phenyl]-4-(2,2-dimethylpropanoylamino)benzamide
CID 1271219
N-[3-[5-(4-methyl-1H-benzimidazol-2-yl)thiophen-2-yl]phenyl]-2-(4-methylpiperazin-1-yl)acetamide
CID 44530779

Frequently Asked Questions

What is the IUPAC name of N-[3-[3-(4-methyl-1H-benzimidazol-2-yl)phenyl]phenyl]-1H-imidazole-5-carboxamide?
The IUPAC name of N-[3-[3-(4-methyl-1H-benzimidazol-2-yl)phenyl]phenyl]-1H-imidazole-5-carboxamide (CID 44530727) is N-[3-[3-(4-methyl-1H-benzimidazol-2-yl)phenyl]phenyl]-1H-imidazole-5-carboxamide.
What is the SMILES notation for N-[3-[3-(4-methyl-1H-benzimidazol-2-yl)phenyl]phenyl]-1H-imidazole-5-carboxamide?
The canonical SMILES for N-[3-[3-(4-methyl-1H-benzimidazol-2-yl)phenyl]phenyl]-1H-imidazole-5-carboxamide is Cc1cccc2[nH]c(-c3cccc(-c4cccc(NC(=O)c5cnc[nH]5)c4)c3)nc12.
What is the InChIKey of N-[3-[3-(4-methyl-1H-benzimidazol-2-yl)phenyl]phenyl]-1H-imidazole-5-carboxamide?
The InChIKey is KWJOXVPRQDZMCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19N5O/c1-15-5-2-10-20-22(15)29-23(28-20)18-8-3-6-16(11-18)17-7-4-9-19(12-17)27-24(30)21-13-25-14-26-21/h2-14H,1H3,(H,25,26)(H,27,30)(H,28,29).
What are the key properties of N-[3-[3-(4-methyl-1H-benzimidazol-2-yl)phenyl]phenyl]-1H-imidazole-5-carboxamide?
N-[3-[3-(4-methyl-1H-benzimidazol-2-yl)phenyl]phenyl]-1H-imidazole-5-carboxamide has a molecular weight of 393.45 g/mol, XLogP of 5.18, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[3-(4-methyl-1H-benzimidazol-2-yl)phenyl]phenyl]-1H-imidazole-5-carboxamide is sourced from PubChem (CID 44530727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).