N-(3-acetylphenyl)-2-(1-methylpiperidin-2-yl)acetamide

C16H22N2O2 — CID 110861048

IUPACN-(3-acetylphenyl)-2-(1-methylpiperidin-2-yl)acetamide
SMILESCC(=O)c1cccc(NC(=O)CC2CCCCN2C)c1
InChIInChI=1S/C16H22N2O2/c1-12(19)13-6-5-7-14(10-13)17-16(20)11-15-8-3-4-9-18(15)2/h5-7,10,15H,3-4,8-9,11H2,1-2H3,(H,17,20)
InChIKeyWSCNTNGKERSYPQ-UHFFFAOYSA-N
MW274.36 g/mol
LogP2.70
Rot. Bonds4

About N-(3-acetylphenyl)-2-(1-methylpiperidin-2-yl)acetamide

N-(3-acetylphenyl)-2-(1-methylpiperidin-2-yl)acetamide (PubChem CID 110861048) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is N-(3-acetylphenyl)-2-(1-methylpiperidin-2-yl)acetamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-2-(1-methylpiperidin-2-yl)acetamide
PubChem CID110861048
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC NameN-(3-acetylphenyl)-2-(1-methylpiperidin-2-yl)acetamide
SMILESCC(=O)c1cccc(NC(=O)CC2CCCCN2C)c1
InChIInChI=1S/C16H22N2O2/c1-12(19)13-6-5-7-14(10-13)17-16(20)11-15-8-3-4-9-18(15)2/h5-7,10,15H,3-4,8-9,11H2,1-2H3,(H,17,20)
InChIKeyWSCNTNGKERSYPQ-UHFFFAOYSA-N
XLogP2.70
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-cyanophenyl)-2-(1-methylpiperidin-2-yl)acetamide
CID 110864817
N-(4-acetylphenyl)-2-(1-methylpyrrolidin-2-yl)acetamide
CID 110861173
N-(4-methylphenyl)-2-(1-methylpiperidin-2-yl)acetamide
CID 110856796
N-(2,6-dimethylphenyl)-2-(1-methylpiperidin-2-yl)acetamide
CID 110857550
2-(1-methylpiperidin-2-yl)-N-(4-pyrrolidin-1-ylphenyl)acetamide
CID 110862093
N-(3,4-dimethylphenyl)-2-(1-methylpyrrolidin-2-yl)acetamide
CID 110857374
N-(3-acetylphenyl)-2-(hydroxymethyl)piperidine-1-carboxamide
CID 61346659
N-(3-chloro-4-methoxyphenyl)-2-(1-methylpiperidin-2-yl)acetamide
CID 110859529
N-(4-methylphenyl)-2-(1-methylpyrrolidin-2-yl)acetamide
CID 110856788
N-(3-acetylphenyl)-2-propylpiperidine-1-carboxamide
CID 83046098
N-(3-acetylphenyl)-2-ethylpiperidine-1-carbothioamide
CID 19654734
N-(3-acetylphenyl)-3-(2-ethylpiperidine-1-carbonyl)benzamide
CID 109056486

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-2-(1-methylpiperidin-2-yl)acetamide?
The IUPAC name of N-(3-acetylphenyl)-2-(1-methylpiperidin-2-yl)acetamide (CID 110861048) is N-(3-acetylphenyl)-2-(1-methylpiperidin-2-yl)acetamide.
What is the SMILES notation for N-(3-acetylphenyl)-2-(1-methylpiperidin-2-yl)acetamide?
The canonical SMILES for N-(3-acetylphenyl)-2-(1-methylpiperidin-2-yl)acetamide is CC(=O)c1cccc(NC(=O)CC2CCCCN2C)c1.
What is the InChIKey of N-(3-acetylphenyl)-2-(1-methylpiperidin-2-yl)acetamide?
The InChIKey is WSCNTNGKERSYPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c1-12(19)13-6-5-7-14(10-13)17-16(20)11-15-8-3-4-9-18(15)2/h5-7,10,15H,3-4,8-9,11H2,1-2H3,(H,17,20).
What are the key properties of N-(3-acetylphenyl)-2-(1-methylpiperidin-2-yl)acetamide?
N-(3-acetylphenyl)-2-(1-methylpiperidin-2-yl)acetamide has a molecular weight of 274.36 g/mol, XLogP of 2.70, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-2-(1-methylpiperidin-2-yl)acetamide is sourced from PubChem (CID 110861048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).