N-cyclopentyl-2-[[2-(2-ethylpiperidin-1-yl)acetyl]amino]benzamide

C21H31N3O2 — CID 46800658

IUPACN-cyclopentyl-2-[[2-(2-ethylpiperidin-1-yl)acetyl]amino]benzamide
SMILESCCC1CCCCN1CC(=O)Nc1ccccc1C(=O)NC1CCCC1
InChIInChI=1S/C21H31N3O2/c1-2-17-11-7-8-14-24(17)15-20(25)23-19-13-6-5-12-18(19)21(26)22-16-9-3-4-10-16/h5-6,12-13,16-17H,2-4,7-11,14-15H2,1H3,(H,22,26)(H,23,25)
InChIKeyGRCYYRAOLCYZEA-UHFFFAOYSA-N
MW357.50 g/mol
LogP3.56
Rot. Bonds6

About N-cyclopentyl-2-[[2-(2-ethylpiperidin-1-yl)acetyl]amino]benzamide

N-cyclopentyl-2-[[2-(2-ethylpiperidin-1-yl)acetyl]amino]benzamide (PubChem CID 46800658) has the molecular formula C21H31N3O2 and a molecular weight of 357.50 g/mol. Its IUPAC name is N-cyclopentyl-2-[[2-(2-ethylpiperidin-1-yl)acetyl]amino]benzamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[[2-(2-ethylpiperidin-1-yl)acetyl]amino]benzamide
PubChem CID46800658
Molecular FormulaC21H31N3O2
Molecular Weight357.50 g/mol
Exact Mass357.24
IUPAC NameN-cyclopentyl-2-[[2-(2-ethylpiperidin-1-yl)acetyl]amino]benzamide
SMILESCCC1CCCCN1CC(=O)Nc1ccccc1C(=O)NC1CCCC1
InChIInChI=1S/C21H31N3O2/c1-2-17-11-7-8-14-24(17)15-20(25)23-19-13-6-5-12-18(19)21(26)22-16-9-3-4-10-16/h5-6,12-13,16-17H,2-4,7-11,14-15H2,1H3,(H,22,26)(H,23,25)
InChIKeyGRCYYRAOLCYZEA-UHFFFAOYSA-N
XLogP3.56
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.50
LogP ≤ 53.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 2-[(2R)-1-[2-[2-(cyclopropylcarbamoyl)anilino]-2-oxoethyl]piperidin-2-yl]acetate
CID 51965662
2-(2-ethylpiperidin-1-yl)-N-(2-methylphenyl)acetamide
CID 78787228
N-cyclopentyl-2-[[2-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]acetyl]amino]benzamide
CID 46615258
N-[2-(aminomethyl)phenyl]-2-(2-ethylazepan-1-yl)acetamide
CID 104689093
N-(2-cyanophenyl)-2-(2-ethylpiperidin-1-yl)acetamide
CID 43212873
N-cyclopentyl-2-[[2-[(2S)-2-thiophen-2-ylpyrrolidin-1-yl]acetyl]amino]benzamide
CID 9166376
N-cyclopropyl-2-[[2-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]acetyl]amino]benzamide
CID 9292689
N-cyclopentyl-2-[(2-methylsulfanylacetyl)amino]benzamide
CID 26084225
N-cyclopentyl-2-[[2-(4-phenylpiperazin-1-yl)acetyl]amino]benzamide
CID 8688467
N-(2-acetylphenyl)-2-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]acetamide
CID 63297555
2-[[2-[(3aR,7aS)-7-oxo-2,3,3a,4,5,7a-hexahydropyrano[3,4-b]pyrrol-1-yl]acetyl]amino]-N-cyclopentylbenzamide
CID 100904411
2-[[2-[(3aS,7aR)-7-oxo-2,3,3a,4,5,7a-hexahydropyrano[3,4-b]pyrrol-1-yl]acetyl]amino]-N-cyclopentylbenzamide
CID 97328215

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-[[2-(2-ethylpiperidin-1-yl)acetyl]amino]benzamide?
The IUPAC name of N-cyclopentyl-2-[[2-(2-ethylpiperidin-1-yl)acetyl]amino]benzamide (CID 46800658) is N-cyclopentyl-2-[[2-(2-ethylpiperidin-1-yl)acetyl]amino]benzamide.
What is the SMILES notation for N-cyclopentyl-2-[[2-(2-ethylpiperidin-1-yl)acetyl]amino]benzamide?
The canonical SMILES for N-cyclopentyl-2-[[2-(2-ethylpiperidin-1-yl)acetyl]amino]benzamide is CCC1CCCCN1CC(=O)Nc1ccccc1C(=O)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-2-[[2-(2-ethylpiperidin-1-yl)acetyl]amino]benzamide?
The InChIKey is GRCYYRAOLCYZEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H31N3O2/c1-2-17-11-7-8-14-24(17)15-20(25)23-19-13-6-5-12-18(19)21(26)22-16-9-3-4-10-16/h5-6,12-13,16-17H,2-4,7-11,14-15H2,1H3,(H,22,26)(H,23,25).
What are the key properties of N-cyclopentyl-2-[[2-(2-ethylpiperidin-1-yl)acetyl]amino]benzamide?
N-cyclopentyl-2-[[2-(2-ethylpiperidin-1-yl)acetyl]amino]benzamide has a molecular weight of 357.50 g/mol, XLogP of 3.56, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-[[2-(2-ethylpiperidin-1-yl)acetyl]amino]benzamide is sourced from PubChem (CID 46800658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).