N-cyclohexyl-4-(2-oxopyrrolidin-1-yl)benzamide

C17H22N2O2 — CID 3238606

IUPACN-cyclohexyl-4-(2-oxopyrrolidin-1-yl)benzamide
SMILESO=C(NC1CCCCC1)c1ccc(N2CCCC2=O)cc1
InChIInChI=1S/C17H22N2O2/c20-16-7-4-12-19(16)15-10-8-13(9-11-15)17(21)18-14-5-2-1-3-6-14/h8-11,14H,1-7,12H2,(H,18,21)
InChIKeyGUMQBVGAPSISDU-UHFFFAOYSA-N
MW286.37 g/mol
LogP2.88
Rot. Bonds3

About N-cyclohexyl-4-(2-oxopyrrolidin-1-yl)benzamide

N-cyclohexyl-4-(2-oxopyrrolidin-1-yl)benzamide (PubChem CID 3238606) has the molecular formula C17H22N2O2 and a molecular weight of 286.37 g/mol. Its IUPAC name is N-cyclohexyl-4-(2-oxopyrrolidin-1-yl)benzamide.

Molecular Properties

Compound NameN-cyclohexyl-4-(2-oxopyrrolidin-1-yl)benzamide
PubChem CID3238606
Molecular FormulaC17H22N2O2
Molecular Weight286.37 g/mol
Exact Mass286.17
IUPAC NameN-cyclohexyl-4-(2-oxopyrrolidin-1-yl)benzamide
SMILESO=C(NC1CCCCC1)c1ccc(N2CCCC2=O)cc1
InChIInChI=1S/C17H22N2O2/c20-16-7-4-12-19(16)15-10-8-13(9-11-15)17(21)18-14-5-2-1-3-6-14/h8-11,14H,1-7,12H2,(H,18,21)
InChIKeyGUMQBVGAPSISDU-UHFFFAOYSA-N
XLogP2.88
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.37
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-(2-oxopyrrolidin-1-yl)benzamide?
The IUPAC name of N-cyclohexyl-4-(2-oxopyrrolidin-1-yl)benzamide (CID 3238606) is N-cyclohexyl-4-(2-oxopyrrolidin-1-yl)benzamide.
What is the SMILES notation for N-cyclohexyl-4-(2-oxopyrrolidin-1-yl)benzamide?
The canonical SMILES for N-cyclohexyl-4-(2-oxopyrrolidin-1-yl)benzamide is O=C(NC1CCCCC1)c1ccc(N2CCCC2=O)cc1.
What is the InChIKey of N-cyclohexyl-4-(2-oxopyrrolidin-1-yl)benzamide?
The InChIKey is GUMQBVGAPSISDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O2/c20-16-7-4-12-19(16)15-10-8-13(9-11-15)17(21)18-14-5-2-1-3-6-14/h8-11,14H,1-7,12H2,(H,18,21).
What are the key properties of N-cyclohexyl-4-(2-oxopyrrolidin-1-yl)benzamide?
N-cyclohexyl-4-(2-oxopyrrolidin-1-yl)benzamide has a molecular weight of 286.37 g/mol, XLogP of 2.88, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-(2-oxopyrrolidin-1-yl)benzamide is sourced from PubChem (CID 3238606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).