N-(1H-indol-6-yl)-4-(4-methoxy-2-oxo-3H-benzimidazol-1-yl)cyclohexane-1-carboxamide

C23H24N4O3 — CID 155466242

IUPACN-(1H-indol-6-yl)-4-(4-methoxy-2-oxo-3H-benzimidazol-1-yl)cyclohexane-1-carboxamide
SMILESCOc1cccc2c1[nH]c(=O)n2C1CCC(C(=O)Nc2ccc3cc[nH]c3c2)CC1
InChIInChI=1S/C23H24N4O3/c1-30-20-4-2-3-19-21(20)26-23(29)27(19)17-9-6-15(7-10-17)22(28)25-16-8-5-14-11-12-24-18(14)13-16/h2-5,8,11-13,15,17,24H,6-7,9-10H2,1H3,(H,25,28)(H,26,29)
InChIKeyHNYMKLIBHFPTFL-UHFFFAOYSA-N
MW404.47 g/mol
LogP4.19
Rot. Bonds4

About N-(1H-indol-6-yl)-4-(4-methoxy-2-oxo-3H-benzimidazol-1-yl)cyclohexane-1-carboxamide

N-(1H-indol-6-yl)-4-(4-methoxy-2-oxo-3H-benzimidazol-1-yl)cyclohexane-1-carboxamide (PubChem CID 155466242) has the molecular formula C23H24N4O3 and a molecular weight of 404.47 g/mol. Its IUPAC name is N-(1H-indol-6-yl)-4-(4-methoxy-2-oxo-3H-benzimidazol-1-yl)cyclohexane-1-carboxamide.

Molecular Properties

Compound NameN-(1H-indol-6-yl)-4-(4-methoxy-2-oxo-3H-benzimidazol-1-yl)cyclohexane-1-carboxamide
PubChem CID155466242
Molecular FormulaC23H24N4O3
Molecular Weight404.47 g/mol
Exact Mass404.18
IUPAC NameN-(1H-indol-6-yl)-4-(4-methoxy-2-oxo-3H-benzimidazol-1-yl)cyclohexane-1-carboxamide
SMILESCOc1cccc2c1[nH]c(=O)n2C1CCC(C(=O)Nc2ccc3cc[nH]c3c2)CC1
InChIInChI=1S/C23H24N4O3/c1-30-20-4-2-3-19-21(20)26-23(29)27(19)17-9-6-15(7-10-17)22(28)25-16-8-5-14-11-12-24-18(14)13-16/h2-5,8,11-13,15,17,24H,6-7,9-10H2,1H3,(H,25,28)(H,26,29)
InChIKeyHNYMKLIBHFPTFL-UHFFFAOYSA-N
XLogP4.19
TPSA91.91 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.47
LogP ≤ 54.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-(1H-indol-6-yl)-4-(4-methoxy-2-oxo-3H-benzimidazol-1-yl)cyclohexane-1-carboxamide 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

N-(3-methoxy-4-methylphenyl)-4-[4-[methyl-[2-(methylamino)ethyl]amino]-2-oxo-3H-benzimidazol-1-yl]cyclohexane-1-carboxamide
CID 153337751
benzyl 1-[4-[(3-methoxy-4-methylphenyl)carbamoyl]cyclohexyl]-2-oxo-3H-benzimidazole-4-carboxylate
CID 150634061
4-(6-fluoro-2-oxo-3H-benzimidazol-1-yl)-N-(3-methoxy-4-methylphenyl)cyclohexane-1-carboxamide
CID 147015751
N-[1-[4-[(3-methoxy-4-methylphenyl)carbamoyl]cyclohexyl]-2-oxo-3H-benzimidazol-4-yl]-5-methyl-1,2-oxazole-3-carboxamide
CID 151661173
N-(4-methoxy-3-methylphenyl)-4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)cyclohexane-1-carboxamide
CID 153337742
4-[4-[(3R)-3-(dimethylamino)pyrrolidine-1-carbonyl]-2-oxo-3H-benzimidazol-1-yl]-N-(3-methoxy-4-methylphenyl)cyclohexane-1-carboxamide
CID 155679470
4-(4-bromo-2-oxo-3H-benzimidazol-1-yl)-N-(4-hydroxy-3-methylphenyl)cyclohexane-1-carboxamide
CID 153337782
3-cyclohexyl-7-methoxy-1H-benzimidazol-2-one
CID 117206936
4-(4-bromo-2-oxo-3H-benzimidazol-1-yl)-N-(4-chloro-3-methylphenyl)cyclohexane-1-carboxamide
CID 151686592
7-methoxy-3-(oxan-4-yl)-1H-benzimidazol-2-one
CID 117206184
N-(1H-indol-6-yl)cycloheptanecarboxamide
CID 154864355
N-(1H-indol-6-yl)-1-methylsulfonylpiperidine-4-carboxamide
CID 110730828

Frequently Asked Questions

What is the IUPAC name of N-(1H-indol-6-yl)-4-(4-methoxy-2-oxo-3H-benzimidazol-1-yl)cyclohexane-1-carboxamide?
The IUPAC name of N-(1H-indol-6-yl)-4-(4-methoxy-2-oxo-3H-benzimidazol-1-yl)cyclohexane-1-carboxamide (CID 155466242) is N-(1H-indol-6-yl)-4-(4-methoxy-2-oxo-3H-benzimidazol-1-yl)cyclohexane-1-carboxamide.
What is the SMILES notation for N-(1H-indol-6-yl)-4-(4-methoxy-2-oxo-3H-benzimidazol-1-yl)cyclohexane-1-carboxamide?
The canonical SMILES for N-(1H-indol-6-yl)-4-(4-methoxy-2-oxo-3H-benzimidazol-1-yl)cyclohexane-1-carboxamide is COc1cccc2c1[nH]c(=O)n2C1CCC(C(=O)Nc2ccc3cc[nH]c3c2)CC1.
What is the InChIKey of N-(1H-indol-6-yl)-4-(4-methoxy-2-oxo-3H-benzimidazol-1-yl)cyclohexane-1-carboxamide?
The InChIKey is HNYMKLIBHFPTFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O3/c1-30-20-4-2-3-19-21(20)26-23(29)27(19)17-9-6-15(7-10-17)22(28)25-16-8-5-14-11-12-24-18(14)13-16/h2-5,8,11-13,15,17,24H,6-7,9-10H2,1H3,(H,25,28)(H,26,29).
What are the key properties of N-(1H-indol-6-yl)-4-(4-methoxy-2-oxo-3H-benzimidazol-1-yl)cyclohexane-1-carboxamide?
N-(1H-indol-6-yl)-4-(4-methoxy-2-oxo-3H-benzimidazol-1-yl)cyclohexane-1-carboxamide has a molecular weight of 404.47 g/mol, XLogP of 4.19, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indol-6-yl)-4-(4-methoxy-2-oxo-3H-benzimidazol-1-yl)cyclohexane-1-carboxamide is sourced from PubChem (CID 155466242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).