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

C24H21ClN2O3 — CID 18288988

IUPACN-[4-(2-chlorophenoxy)phenyl]-4-(2-oxopiperidin-1-yl)benzamide
SMILESO=C(Nc1ccc(Oc2ccccc2Cl)cc1)c1ccc(N2CCCCC2=O)cc1
InChIInChI=1S/C24H21ClN2O3/c25-21-5-1-2-6-22(21)30-20-14-10-18(11-15-20)26-24(29)17-8-12-19(13-9-17)27-16-4-3-7-23(27)28/h1-2,5-6,8-15H,3-4,7,16H2,(H,26,29)
InChIKeyGXIOOXZRFYRPLW-UHFFFAOYSA-N
MW420.90 g/mol
LogP5.90
Rot. Bonds5

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

N-[4-(2-chlorophenoxy)phenyl]-4-(2-oxopiperidin-1-yl)benzamide (PubChem CID 18288988) has the molecular formula C24H21ClN2O3 and a molecular weight of 420.90 g/mol. Its IUPAC name is N-[4-(2-chlorophenoxy)phenyl]-4-(2-oxopiperidin-1-yl)benzamide.

Molecular Properties

Compound NameN-[4-(2-chlorophenoxy)phenyl]-4-(2-oxopiperidin-1-yl)benzamide
PubChem CID18288988
Molecular FormulaC24H21ClN2O3
Molecular Weight420.90 g/mol
Exact Mass420.12
IUPAC NameN-[4-(2-chlorophenoxy)phenyl]-4-(2-oxopiperidin-1-yl)benzamide
SMILESO=C(Nc1ccc(Oc2ccccc2Cl)cc1)c1ccc(N2CCCCC2=O)cc1
InChIInChI=1S/C24H21ClN2O3/c25-21-5-1-2-6-22(21)30-20-14-10-18(11-15-20)26-24(29)17-8-12-19(13-9-17)27-16-4-3-7-23(27)28/h1-2,5-6,8-15H,3-4,7,16H2,(H,26,29)
InChIKeyGXIOOXZRFYRPLW-UHFFFAOYSA-N
XLogP5.90
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500420.90
LogP ≤ 55.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-chlorophenyl)-4-(2-oxopiperidin-1-yl)benzamide
CID 36678322
N-(4-methoxyphenyl)-4-(2-oxopyrrolidin-1-yl)benzamide
CID 9412020
2-chloro-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 7686374
N-(4-acetylphenyl)-4-(2-oxopiperidin-1-yl)benzamide
CID 9242933
N-[2-(4-methylphenoxy)phenyl]-4-(2-oxopyrrolidin-1-yl)benzamide
CID 24681364
3-chloro-N-[4-(2-oxopiperidin-1-yl)phenyl]benzamide
CID 7687271
4-(2-oxopyrrolidin-1-yl)-N-(4-piperidin-1-ylphenyl)benzamide
CID 7922377
4-acetamido-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 78788340
methyl 4-[[4-(2-oxopyrrolidin-1-yl)phenyl]carbamoyl]benzoate
CID 8747295
4-(carbamoylamino)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 26127679
N-[3-methoxy-4-(2-oxopyrrolidin-1-yl)phenyl]-4-(2-oxopiperidin-1-yl)benzamide
CID 18140044
3,4-dimethyl-N-[4-(2-oxopiperidin-1-yl)phenyl]benzamide
CID 7687280

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-chlorophenoxy)phenyl]-4-(2-oxopiperidin-1-yl)benzamide?
The IUPAC name of N-[4-(2-chlorophenoxy)phenyl]-4-(2-oxopiperidin-1-yl)benzamide (CID 18288988) is N-[4-(2-chlorophenoxy)phenyl]-4-(2-oxopiperidin-1-yl)benzamide.
What is the SMILES notation for N-[4-(2-chlorophenoxy)phenyl]-4-(2-oxopiperidin-1-yl)benzamide?
The canonical SMILES for N-[4-(2-chlorophenoxy)phenyl]-4-(2-oxopiperidin-1-yl)benzamide is O=C(Nc1ccc(Oc2ccccc2Cl)cc1)c1ccc(N2CCCCC2=O)cc1.
What is the InChIKey of N-[4-(2-chlorophenoxy)phenyl]-4-(2-oxopiperidin-1-yl)benzamide?
The InChIKey is GXIOOXZRFYRPLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21ClN2O3/c25-21-5-1-2-6-22(21)30-20-14-10-18(11-15-20)26-24(29)17-8-12-19(13-9-17)27-16-4-3-7-23(27)28/h1-2,5-6,8-15H,3-4,7,16H2,(H,26,29).
What are the key properties of N-[4-(2-chlorophenoxy)phenyl]-4-(2-oxopiperidin-1-yl)benzamide?
N-[4-(2-chlorophenoxy)phenyl]-4-(2-oxopiperidin-1-yl)benzamide has a molecular weight of 420.90 g/mol, XLogP of 5.90, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-chlorophenoxy)phenyl]-4-(2-oxopiperidin-1-yl)benzamide is sourced from PubChem (CID 18288988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).