2-(3-acetamidopiperidin-1-yl)-N-(4-methylphenyl)acetamide

C16H23N3O2 — CID 60511665

IUPAC2-(3-acetamidopiperidin-1-yl)-N-(4-methylphenyl)acetamide
SMILESCC(=O)NC1CCCN(CC(=O)Nc2ccc(C)cc2)C1
InChIInChI=1S/C16H23N3O2/c1-12-5-7-14(8-6-12)18-16(21)11-19-9-3-4-15(10-19)17-13(2)20/h5-8,15H,3-4,9-11H2,1-2H3,(H,17,20)(H,18,21)
InChIKeyRZVWEFWPGNKSNU-UHFFFAOYSA-N
MW289.38 g/mol
LogP1.53
Rot. Bonds4

About 2-(3-acetamidopiperidin-1-yl)-N-(4-methylphenyl)acetamide

2-(3-acetamidopiperidin-1-yl)-N-(4-methylphenyl)acetamide (PubChem CID 60511665) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is 2-(3-acetamidopiperidin-1-yl)-N-(4-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(3-acetamidopiperidin-1-yl)-N-(4-methylphenyl)acetamide
PubChem CID60511665
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC Name2-(3-acetamidopiperidin-1-yl)-N-(4-methylphenyl)acetamide
SMILESCC(=O)NC1CCCN(CC(=O)Nc2ccc(C)cc2)C1
InChIInChI=1S/C16H23N3O2/c1-12-5-7-14(8-6-12)18-16(21)11-19-9-3-4-15(10-19)17-13(2)20/h5-8,15H,3-4,9-11H2,1-2H3,(H,17,20)(H,18,21)
InChIKeyRZVWEFWPGNKSNU-UHFFFAOYSA-N
XLogP1.53
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-acetamidopiperidin-1-yl)-N-phenylacetamide
CID 60503649
2-[3-(methanesulfonamido)piperidin-1-yl]-N-(4-methylphenyl)acetamide
CID 163352401
2-(3-aminopiperidin-1-yl)-N-(4-methylphenyl)acetamide
CID 61297774
3-[[2-(3-acetamidopiperidin-1-yl)acetyl]amino]-N,N-dimethylbenzamide
CID 87017774
2-[(3S)-3-acetamidopiperidin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 94190647
2-[3-(methylamino)piperidin-1-yl]-N-pyridin-4-ylacetamide
CID 119918337
2-[3-(methylamino)piperidin-1-yl]-N-pyridin-4-ylacetamide;dihydrochloride
CID 119918336
N-(4-aminophenyl)-2-(3-methylpiperidin-1-yl)acetamide
CID 16779145
N-(3,4-dichlorophenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide
CID 62545984
2-[3-(hydroxymethyl)pyrrolidin-1-yl]-N-(4-methylphenyl)acetamide
CID 62372251
2-(4-acetamidopiperidin-1-yl)-N-(4-ethylphenyl)acetamide
CID 3220742
N-(4-acetylphenyl)-2-(3-methylpiperidin-1-yl)acetamide
CID 6914795

Frequently Asked Questions

What is the IUPAC name of 2-(3-acetamidopiperidin-1-yl)-N-(4-methylphenyl)acetamide?
The IUPAC name of 2-(3-acetamidopiperidin-1-yl)-N-(4-methylphenyl)acetamide (CID 60511665) is 2-(3-acetamidopiperidin-1-yl)-N-(4-methylphenyl)acetamide.
What is the SMILES notation for 2-(3-acetamidopiperidin-1-yl)-N-(4-methylphenyl)acetamide?
The canonical SMILES for 2-(3-acetamidopiperidin-1-yl)-N-(4-methylphenyl)acetamide is CC(=O)NC1CCCN(CC(=O)Nc2ccc(C)cc2)C1.
What is the InChIKey of 2-(3-acetamidopiperidin-1-yl)-N-(4-methylphenyl)acetamide?
The InChIKey is RZVWEFWPGNKSNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c1-12-5-7-14(8-6-12)18-16(21)11-19-9-3-4-15(10-19)17-13(2)20/h5-8,15H,3-4,9-11H2,1-2H3,(H,17,20)(H,18,21).
What are the key properties of 2-(3-acetamidopiperidin-1-yl)-N-(4-methylphenyl)acetamide?
2-(3-acetamidopiperidin-1-yl)-N-(4-methylphenyl)acetamide has a molecular weight of 289.38 g/mol, XLogP of 1.53, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-acetamidopiperidin-1-yl)-N-(4-methylphenyl)acetamide is sourced from PubChem (CID 60511665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).