3-chloro-N-[4-(2-oxopiperidin-1-yl)phenyl]benzamide

C18H17ClN2O2 — CID 7687271

IUPAC3-chloro-N-[4-(2-oxopiperidin-1-yl)phenyl]benzamide
SMILESO=C(Nc1ccc(N2CCCCC2=O)cc1)c1cccc(Cl)c1
InChIInChI=1S/C18H17ClN2O2/c19-14-5-3-4-13(12-14)18(23)20-15-7-9-16(10-8-15)21-11-2-1-6-17(21)22/h3-5,7-10,12H,1-2,6,11H2,(H,20,23)
InChIKeyQLHJPEJALUFREM-UHFFFAOYSA-N
MW328.80 g/mol
LogP4.11
Rot. Bonds3

About 3-chloro-N-[4-(2-oxopiperidin-1-yl)phenyl]benzamide

3-chloro-N-[4-(2-oxopiperidin-1-yl)phenyl]benzamide (PubChem CID 7687271) has the molecular formula C18H17ClN2O2 and a molecular weight of 328.80 g/mol. Its IUPAC name is 3-chloro-N-[4-(2-oxopiperidin-1-yl)phenyl]benzamide.

Molecular Properties

Compound Name3-chloro-N-[4-(2-oxopiperidin-1-yl)phenyl]benzamide
PubChem CID7687271
Molecular FormulaC18H17ClN2O2
Molecular Weight328.80 g/mol
Exact Mass328.10
IUPAC Name3-chloro-N-[4-(2-oxopiperidin-1-yl)phenyl]benzamide
SMILESO=C(Nc1ccc(N2CCCCC2=O)cc1)c1cccc(Cl)c1
InChIInChI=1S/C18H17ClN2O2/c19-14-5-3-4-13(12-14)18(23)20-15-7-9-16(10-8-15)21-11-2-1-6-17(21)22/h3-5,7-10,12H,1-2,6,11H2,(H,20,23)
InChIKeyQLHJPEJALUFREM-UHFFFAOYSA-N
XLogP4.11
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.80
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-chlorophenyl)-4-(2-oxopiperidin-1-yl)benzamide
CID 36678322
3,4-dimethyl-N-[4-(2-oxopiperidin-1-yl)phenyl]benzamide
CID 7687280
2-chloro-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 7686374
N-(4-acetylphenyl)-4-(2-oxopiperidin-1-yl)benzamide
CID 9242933
3-(3-methyliminobut-1-ynyl)-N-[4-(2-oxopiperidin-1-yl)phenyl]benzamide
CID 170013883
N-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-3-(2-oxopyrrolidin-1-yl)benzamide
CID 110618989
N-(4-carbamoylphenyl)-3-(2-oxopyrrolidin-1-yl)benzamide
CID 35133090
3-chloro-N-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide
CID 17172890
N-[4-(2-chlorophenoxy)phenyl]-4-(2-oxopiperidin-1-yl)benzamide
CID 18288988
4-(2-oxopyrrolidin-1-yl)-N-(4-piperidin-1-ylphenyl)benzamide
CID 7922377
3-chloro-N-[4-(piperidine-1-carbonyl)phenyl]benzamide
CID 2970403
N,N-dimethyl-3-[[4-(2-oxopiperidin-1-yl)benzoyl]amino]benzamide
CID 51339093

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-[4-(2-oxopiperidin-1-yl)phenyl]benzamide?
The IUPAC name of 3-chloro-N-[4-(2-oxopiperidin-1-yl)phenyl]benzamide (CID 7687271) is 3-chloro-N-[4-(2-oxopiperidin-1-yl)phenyl]benzamide.
What is the SMILES notation for 3-chloro-N-[4-(2-oxopiperidin-1-yl)phenyl]benzamide?
The canonical SMILES for 3-chloro-N-[4-(2-oxopiperidin-1-yl)phenyl]benzamide is O=C(Nc1ccc(N2CCCCC2=O)cc1)c1cccc(Cl)c1.
What is the InChIKey of 3-chloro-N-[4-(2-oxopiperidin-1-yl)phenyl]benzamide?
The InChIKey is QLHJPEJALUFREM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17ClN2O2/c19-14-5-3-4-13(12-14)18(23)20-15-7-9-16(10-8-15)21-11-2-1-6-17(21)22/h3-5,7-10,12H,1-2,6,11H2,(H,20,23).
What are the key properties of 3-chloro-N-[4-(2-oxopiperidin-1-yl)phenyl]benzamide?
3-chloro-N-[4-(2-oxopiperidin-1-yl)phenyl]benzamide has a molecular weight of 328.80 g/mol, XLogP of 4.11, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-[4-(2-oxopiperidin-1-yl)phenyl]benzamide is sourced from PubChem (CID 7687271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).