N-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]-4-phenylbenzamide

C25H24N2O3 — CID 7687543

IUPACN-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]-4-phenylbenzamide
SMILESCOc1cc(NC(=O)c2ccc(-c3ccccc3)cc2)ccc1N1CCCCC1=O
InChIInChI=1S/C25H24N2O3/c1-30-23-17-21(14-15-22(23)27-16-6-5-9-24(27)28)26-25(29)20-12-10-19(11-13-20)18-7-3-2-4-8-18/h2-4,7-8,10-15,17H,5-6,9,16H2,1H3,(H,26,29)
InChIKeyJRGJJWKECSNODY-UHFFFAOYSA-N
MW400.48 g/mol
LogP5.13
Rot. Bonds5

About N-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]-4-phenylbenzamide

N-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]-4-phenylbenzamide (PubChem CID 7687543) has the molecular formula C25H24N2O3 and a molecular weight of 400.48 g/mol. Its IUPAC name is N-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]-4-phenylbenzamide.

Molecular Properties

Compound NameN-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]-4-phenylbenzamide
PubChem CID7687543
Molecular FormulaC25H24N2O3
Molecular Weight400.48 g/mol
Exact Mass400.18
IUPAC NameN-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]-4-phenylbenzamide
SMILESCOc1cc(NC(=O)c2ccc(-c3ccccc3)cc2)ccc1N1CCCCC1=O
InChIInChI=1S/C25H24N2O3/c1-30-23-17-21(14-15-22(23)27-16-6-5-9-24(27)28)26-25(29)20-12-10-19(11-13-20)18-7-3-2-4-8-18/h2-4,7-8,10-15,17H,5-6,9,16H2,1H3,(H,26,29)
InChIKeyJRGJJWKECSNODY-UHFFFAOYSA-N
XLogP5.13
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500400.48
LogP ≤ 55.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-methoxy-4-(2-oxopyrrolidin-1-yl)phenyl]-4-(2-oxopiperidin-1-yl)benzamide
CID 18140044
N-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]-4-(trifluoromethyl)benzamide
CID 7687570
4-methoxy-N-[3-methoxy-4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 7686632
N-[3-methoxy-4-(2-oxopyrrolidin-1-yl)phenyl]-2-(4-phenylphenyl)acetamide
CID 7686701
N-[3-methoxy-4-(2-oxopyrrolidin-1-yl)phenyl]-3,4-dimethylbenzamide
CID 7686708
3,4-diethoxy-N-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]benzamide
CID 7687515
3,4,5-triethoxy-N-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]benzamide
CID 42525029
2-chloro-N-[3-methoxy-4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 7686645
4-(diethylaminomethyl)-N-[3-methoxy-4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 55645760
4-bromo-N-[4-methoxy-3-(2-oxopiperidin-1-yl)phenyl]benzamide
CID 7687877
N-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]-3-nitrobenzamide
CID 7687475
N-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]furan-2-carboxamide
CID 7687540

Frequently Asked Questions

What is the IUPAC name of N-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]-4-phenylbenzamide?
The IUPAC name of N-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]-4-phenylbenzamide (CID 7687543) is N-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]-4-phenylbenzamide.
What is the SMILES notation for N-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]-4-phenylbenzamide?
The canonical SMILES for N-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]-4-phenylbenzamide is COc1cc(NC(=O)c2ccc(-c3ccccc3)cc2)ccc1N1CCCCC1=O.
What is the InChIKey of N-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]-4-phenylbenzamide?
The InChIKey is JRGJJWKECSNODY-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N2O3/c1-30-23-17-21(14-15-22(23)27-16-6-5-9-24(27)28)26-25(29)20-12-10-19(11-13-20)18-7-3-2-4-8-18/h2-4,7-8,10-15,17H,5-6,9,16H2,1H3,(H,26,29).
What are the key properties of N-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]-4-phenylbenzamide?
N-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]-4-phenylbenzamide has a molecular weight of 400.48 g/mol, XLogP of 5.13, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]-4-phenylbenzamide is sourced from PubChem (CID 7687543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).