N-(2-cyclohexyl-6-oxopiperidin-3-yl)-2-(2-methylbenzimidazol-1-yl)acetamide

C21H28N4O2 — CID 46952784

IUPACN-(2-cyclohexyl-6-oxopiperidin-3-yl)-2-(2-methylbenzimidazol-1-yl)acetamide
SMILESCc1nc2ccccc2n1CC(=O)NC1CCC(=O)NC1C1CCCCC1
InChIInChI=1S/C21H28N4O2/c1-14-22-16-9-5-6-10-18(16)25(14)13-20(27)23-17-11-12-19(26)24-21(17)15-7-3-2-4-8-15/h5-6,9-10,15,17,21H,2-4,7-8,11-13H2,1H3,(H,23,27)(H,24,26)
InChIKeyFXMGXJAYIRJZQT-UHFFFAOYSA-N
MW368.48 g/mol
LogP2.69
Rot. Bonds4

About N-(2-cyclohexyl-6-oxopiperidin-3-yl)-2-(2-methylbenzimidazol-1-yl)acetamide

N-(2-cyclohexyl-6-oxopiperidin-3-yl)-2-(2-methylbenzimidazol-1-yl)acetamide (PubChem CID 46952784) has the molecular formula C21H28N4O2 and a molecular weight of 368.48 g/mol. Its IUPAC name is N-(2-cyclohexyl-6-oxopiperidin-3-yl)-2-(2-methylbenzimidazol-1-yl)acetamide.

Molecular Properties

Compound NameN-(2-cyclohexyl-6-oxopiperidin-3-yl)-2-(2-methylbenzimidazol-1-yl)acetamide
PubChem CID46952784
Molecular FormulaC21H28N4O2
Molecular Weight368.48 g/mol
Exact Mass368.22
IUPAC NameN-(2-cyclohexyl-6-oxopiperidin-3-yl)-2-(2-methylbenzimidazol-1-yl)acetamide
SMILESCc1nc2ccccc2n1CC(=O)NC1CCC(=O)NC1C1CCCCC1
InChIInChI=1S/C21H28N4O2/c1-14-22-16-9-5-6-10-18(16)25(14)13-20(27)23-17-11-12-19(26)24-21(17)15-7-3-2-4-8-15/h5-6,9-10,15,17,21H,2-4,7-8,11-13H2,1H3,(H,23,27)(H,24,26)
InChIKeyFXMGXJAYIRJZQT-UHFFFAOYSA-N
XLogP2.69
TPSA76.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.48
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-2-(2-methylbenzimidazol-1-yl)acetamide
CID 7755737
2-(2-methylbenzimidazol-1-yl)-N-(2-methylpiperidin-4-yl)acetamide
CID 120598810
N-[(1S,2S)-2-methylcyclohexyl]-2-(2-methylsulfonylbenzimidazol-1-yl)acetamide
CID 27934156
N-[3-[5-(hydroxymethyl)-4-methyl-1,2,4-triazol-3-yl]cyclobutyl]-2-(2-methylbenzimidazol-1-yl)acetamide
CID 91783286
1-[[2-(2-methylbenzimidazol-1-yl)acetyl]amino]cyclohexane-1-carboxylic acid
CID 56811562
N-cyclohexyl-N-ethyl-2-(2-methylbenzimidazol-1-yl)acetamide
CID 112781129
N-[(3R,4S)-4-(cyclopropylmethoxy)oxan-3-yl]-2-(2-methylbenzimidazol-1-yl)acetamide
CID 91762043
2-(2-cyclohexylbenzimidazol-1-yl)-N-(5-methyl-2-oxo-1H-pyridin-3-yl)acetamide
CID 166348712
N-(2-amino-1-cyclopropylethyl)-2-(2-methylbenzimidazol-1-yl)acetamide
CID 119615273
N-cyclohexyl-2-[2-(4-fluorophenyl)benzimidazol-1-yl]acetamide
CID 1157478
N-cyclohexyl-2-(2-propylbenzimidazol-1-yl)acetamide
CID 17028657
N-cyclopentyl-2-[2-[2-oxo-2-(propan-2-ylamino)ethyl]sulfanylbenzimidazol-1-yl]acetamide
CID 3224649

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexyl-6-oxopiperidin-3-yl)-2-(2-methylbenzimidazol-1-yl)acetamide?
The IUPAC name of N-(2-cyclohexyl-6-oxopiperidin-3-yl)-2-(2-methylbenzimidazol-1-yl)acetamide (CID 46952784) is N-(2-cyclohexyl-6-oxopiperidin-3-yl)-2-(2-methylbenzimidazol-1-yl)acetamide.
What is the SMILES notation for N-(2-cyclohexyl-6-oxopiperidin-3-yl)-2-(2-methylbenzimidazol-1-yl)acetamide?
The canonical SMILES for N-(2-cyclohexyl-6-oxopiperidin-3-yl)-2-(2-methylbenzimidazol-1-yl)acetamide is Cc1nc2ccccc2n1CC(=O)NC1CCC(=O)NC1C1CCCCC1.
What is the InChIKey of N-(2-cyclohexyl-6-oxopiperidin-3-yl)-2-(2-methylbenzimidazol-1-yl)acetamide?
The InChIKey is FXMGXJAYIRJZQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H28N4O2/c1-14-22-16-9-5-6-10-18(16)25(14)13-20(27)23-17-11-12-19(26)24-21(17)15-7-3-2-4-8-15/h5-6,9-10,15,17,21H,2-4,7-8,11-13H2,1H3,(H,23,27)(H,24,26).
What are the key properties of N-(2-cyclohexyl-6-oxopiperidin-3-yl)-2-(2-methylbenzimidazol-1-yl)acetamide?
N-(2-cyclohexyl-6-oxopiperidin-3-yl)-2-(2-methylbenzimidazol-1-yl)acetamide has a molecular weight of 368.48 g/mol, XLogP of 2.69, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexyl-6-oxopiperidin-3-yl)-2-(2-methylbenzimidazol-1-yl)acetamide is sourced from PubChem (CID 46952784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).