N-cyclopentyl-4-[[2-(2-oxopiperidin-1-yl)-2-phenylacetyl]amino]benzamide

C25H29N3O3 — CID 56513712

IUPACN-cyclopentyl-4-[[2-(2-oxopiperidin-1-yl)-2-phenylacetyl]amino]benzamide
SMILESO=C(NC1CCCC1)c1ccc(NC(=O)C(c2ccccc2)N2CCCCC2=O)cc1
InChIInChI=1S/C25H29N3O3/c29-22-12-6-7-17-28(22)23(18-8-2-1-3-9-18)25(31)27-21-15-13-19(14-16-21)24(30)26-20-10-4-5-11-20/h1-3,8-9,13-16,20,23H,4-7,10-12,17H2,(H,26,30)(H,27,31)
InChIKeyNHNGVYHAUMYCAY-UHFFFAOYSA-N
MW419.53 g/mol
LogP4.05
Rot. Bonds6

About N-cyclopentyl-4-[[2-(2-oxopiperidin-1-yl)-2-phenylacetyl]amino]benzamide

N-cyclopentyl-4-[[2-(2-oxopiperidin-1-yl)-2-phenylacetyl]amino]benzamide (PubChem CID 56513712) has the molecular formula C25H29N3O3 and a molecular weight of 419.53 g/mol. Its IUPAC name is N-cyclopentyl-4-[[2-(2-oxopiperidin-1-yl)-2-phenylacetyl]amino]benzamide.

Molecular Properties

Compound NameN-cyclopentyl-4-[[2-(2-oxopiperidin-1-yl)-2-phenylacetyl]amino]benzamide
PubChem CID56513712
Molecular FormulaC25H29N3O3
Molecular Weight419.53 g/mol
Exact Mass419.22
IUPAC NameN-cyclopentyl-4-[[2-(2-oxopiperidin-1-yl)-2-phenylacetyl]amino]benzamide
SMILESO=C(NC1CCCC1)c1ccc(NC(=O)C(c2ccccc2)N2CCCCC2=O)cc1
InChIInChI=1S/C25H29N3O3/c29-22-12-6-7-17-28(22)23(18-8-2-1-3-9-18)25(31)27-21-15-13-19(14-16-21)24(30)26-20-10-4-5-11-20/h1-3,8-9,13-16,20,23H,4-7,10-12,17H2,(H,26,30)(H,27,31)
InChIKeyNHNGVYHAUMYCAY-UHFFFAOYSA-N
XLogP4.05
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500419.53
LogP ≤ 54.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-hydroxycyclohexyl)-2-(2-oxopiperidin-1-yl)-2-phenylacetamide
CID 111113210
3-[[2-(2-oxopiperidin-1-yl)-2-phenylacetyl]amino]benzoic acid
CID 119219540
N-(4-aminocyclohexyl)-2-(2-oxopiperidin-1-yl)-2-phenylacetamide
CID 119476626
N-[4-methyl-3-(trifluoromethyl)phenyl]-2-(2-oxopiperidin-1-yl)-2-phenylacetamide
CID 56515457
N-(3-cyclopentyloxyphenyl)-2-(2-oxopiperidin-1-yl)-2-phenylacetamide
CID 56515228
2-(2-oxopiperidin-1-yl)-2-phenyl-N-[3-(pyrrolidine-1-carbonyl)phenyl]acetamide
CID 56515108
4-benzamido-N-cyclopentylbenzamide
CID 1262350
N-(3-cyclopentylpropyl)-2-(2-oxopiperidin-1-yl)-2-phenylacetamide
CID 56577591
N-(3,5-difluoro-4-pyrrolidin-1-ylphenyl)-2-(2-oxopiperidin-1-yl)-2-phenylacetamide
CID 56513321
N-(cyclopropylmethyl)-2-(2-oxopiperidin-1-yl)-2-phenylacetamide
CID 56515214
N-methyl-2-(2-oxopyrrolidin-1-yl)-2-phenylacetamide
CID 123551367
N-[3-(1,3-dithian-2-yl)phenyl]-2-(2-oxopiperidin-1-yl)-2-phenylacetamide
CID 56516841

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-4-[[2-(2-oxopiperidin-1-yl)-2-phenylacetyl]amino]benzamide?
The IUPAC name of N-cyclopentyl-4-[[2-(2-oxopiperidin-1-yl)-2-phenylacetyl]amino]benzamide (CID 56513712) is N-cyclopentyl-4-[[2-(2-oxopiperidin-1-yl)-2-phenylacetyl]amino]benzamide.
What is the SMILES notation for N-cyclopentyl-4-[[2-(2-oxopiperidin-1-yl)-2-phenylacetyl]amino]benzamide?
The canonical SMILES for N-cyclopentyl-4-[[2-(2-oxopiperidin-1-yl)-2-phenylacetyl]amino]benzamide is O=C(NC1CCCC1)c1ccc(NC(=O)C(c2ccccc2)N2CCCCC2=O)cc1.
What is the InChIKey of N-cyclopentyl-4-[[2-(2-oxopiperidin-1-yl)-2-phenylacetyl]amino]benzamide?
The InChIKey is NHNGVYHAUMYCAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H29N3O3/c29-22-12-6-7-17-28(22)23(18-8-2-1-3-9-18)25(31)27-21-15-13-19(14-16-21)24(30)26-20-10-4-5-11-20/h1-3,8-9,13-16,20,23H,4-7,10-12,17H2,(H,26,30)(H,27,31).
What are the key properties of N-cyclopentyl-4-[[2-(2-oxopiperidin-1-yl)-2-phenylacetyl]amino]benzamide?
N-cyclopentyl-4-[[2-(2-oxopiperidin-1-yl)-2-phenylacetyl]amino]benzamide has a molecular weight of 419.53 g/mol, XLogP of 4.05, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-4-[[2-(2-oxopiperidin-1-yl)-2-phenylacetyl]amino]benzamide is sourced from PubChem (CID 56513712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).