3-[2-[[4-(2-oxopiperidin-1-yl)phenyl]carbamoyl]cyclopenten-1-yl]benzamide

C24H25N3O3 — CID 10272515

IUPAC3-[2-[[4-(2-oxopiperidin-1-yl)phenyl]carbamoyl]cyclopenten-1-yl]benzamide
SMILESNC(=O)c1cccc(C2=C(C(=O)Nc3ccc(N4CCCCC4=O)cc3)CCC2)c1
InChIInChI=1S/C24H25N3O3/c25-23(29)17-6-3-5-16(15-17)20-7-4-8-21(20)24(30)26-18-10-12-19(13-11-18)27-14-2-1-9-22(27)28/h3,5-6,10-13,15H,1-2,4,7-9,14H2,(H2,25,29)(H,26,30)
InChIKeyCIRMKQFIVXTKPI-UHFFFAOYSA-N
MW403.48 g/mol
LogP3.88
Rot. Bonds5

About 3-[2-[[4-(2-oxopiperidin-1-yl)phenyl]carbamoyl]cyclopenten-1-yl]benzamide

3-[2-[[4-(2-oxopiperidin-1-yl)phenyl]carbamoyl]cyclopenten-1-yl]benzamide (PubChem CID 10272515) has the molecular formula C24H25N3O3 and a molecular weight of 403.48 g/mol. Its IUPAC name is 3-[2-[[4-(2-oxopiperidin-1-yl)phenyl]carbamoyl]cyclopenten-1-yl]benzamide.

Molecular Properties

Compound Name3-[2-[[4-(2-oxopiperidin-1-yl)phenyl]carbamoyl]cyclopenten-1-yl]benzamide
PubChem CID10272515
Molecular FormulaC24H25N3O3
Molecular Weight403.48 g/mol
Exact Mass403.19
IUPAC Name3-[2-[[4-(2-oxopiperidin-1-yl)phenyl]carbamoyl]cyclopenten-1-yl]benzamide
SMILESNC(=O)c1cccc(C2=C(C(=O)Nc3ccc(N4CCCCC4=O)cc3)CCC2)c1
InChIInChI=1S/C24H25N3O3/c25-23(29)17-6-3-5-16(15-17)20-7-4-8-21(20)24(30)26-18-10-12-19(13-11-18)27-14-2-1-9-22(27)28/h3,5-6,10-13,15H,1-2,4,7-9,14H2,(H2,25,29)(H,26,30)
InChIKeyCIRMKQFIVXTKPI-UHFFFAOYSA-N
XLogP3.88
TPSA92.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.48
LogP ≤ 53.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-carbamimidoylphenyl)-N-[4-(2-oxopiperidin-1-yl)phenyl]cyclopentene-1-carboxamide
CID 10201129
N-(4-carbamoylphenyl)-3-(2-oxopyrrolidin-1-yl)benzamide
CID 35133090
3-chloro-N-[4-(2-oxopiperidin-1-yl)phenyl]benzamide
CID 7687271
3-[(1S,2R)-2-[[4-(2-oxopiperidin-1-yl)phenyl]carbamoyl]cyclopentyl]benzamide
CID 12018193
N,N-dimethyl-3-[[4-(2-oxopiperidin-1-yl)benzoyl]amino]benzamide
CID 51339093
N-[4-(2-oxopiperidin-1-yl)phenyl]naphthalene-1-carboxamide
CID 7687294
3-[[1-(2-fluorophenyl)-2-oxo-2-[4-(2-oxopiperidin-1-yl)anilino]ethyl]amino]benzamide
CID 69337383
4-(carbamoylamino)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 26127679
N-(3-hydroxyphenyl)-3-(2-oxopyrrolidin-1-yl)benzamide
CID 78816654
2-chloro-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 7686374
N-(4-acetylphenyl)-4-(2-oxopiperidin-1-yl)benzamide
CID 9242933
N-(4-chlorophenyl)-4-(2-oxopiperidin-1-yl)benzamide
CID 36678322

Frequently Asked Questions

What is the IUPAC name of 3-[2-[[4-(2-oxopiperidin-1-yl)phenyl]carbamoyl]cyclopenten-1-yl]benzamide?
The IUPAC name of 3-[2-[[4-(2-oxopiperidin-1-yl)phenyl]carbamoyl]cyclopenten-1-yl]benzamide (CID 10272515) is 3-[2-[[4-(2-oxopiperidin-1-yl)phenyl]carbamoyl]cyclopenten-1-yl]benzamide.
What is the SMILES notation for 3-[2-[[4-(2-oxopiperidin-1-yl)phenyl]carbamoyl]cyclopenten-1-yl]benzamide?
The canonical SMILES for 3-[2-[[4-(2-oxopiperidin-1-yl)phenyl]carbamoyl]cyclopenten-1-yl]benzamide is NC(=O)c1cccc(C2=C(C(=O)Nc3ccc(N4CCCCC4=O)cc3)CCC2)c1.
What is the InChIKey of 3-[2-[[4-(2-oxopiperidin-1-yl)phenyl]carbamoyl]cyclopenten-1-yl]benzamide?
The InChIKey is CIRMKQFIVXTKPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O3/c25-23(29)17-6-3-5-16(15-17)20-7-4-8-21(20)24(30)26-18-10-12-19(13-11-18)27-14-2-1-9-22(27)28/h3,5-6,10-13,15H,1-2,4,7-9,14H2,(H2,25,29)(H,26,30).
What are the key properties of 3-[2-[[4-(2-oxopiperidin-1-yl)phenyl]carbamoyl]cyclopenten-1-yl]benzamide?
3-[2-[[4-(2-oxopiperidin-1-yl)phenyl]carbamoyl]cyclopenten-1-yl]benzamide has a molecular weight of 403.48 g/mol, XLogP of 3.88, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-[[4-(2-oxopiperidin-1-yl)phenyl]carbamoyl]cyclopenten-1-yl]benzamide is sourced from PubChem (CID 10272515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).