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

C16H22N2O2 — CID 110715006

IUPACN-(1-acetylpiperidin-4-yl)-2-(3-methylphenyl)acetamide
SMILESCC(=O)N1CCC(NC(=O)Cc2cccc(C)c2)CC1
InChIInChI=1S/C16H22N2O2/c1-12-4-3-5-14(10-12)11-16(20)17-15-6-8-18(9-7-15)13(2)19/h3-5,10,15H,6-9,11H2,1-2H3,(H,17,20)
InChIKeyORXBTMXGKGJGSK-UHFFFAOYSA-N
MW274.36 g/mol
LogP1.66
Rot. Bonds3

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

N-(1-acetylpiperidin-4-yl)-2-(3-methylphenyl)acetamide (PubChem CID 110715006) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is N-(1-acetylpiperidin-4-yl)-2-(3-methylphenyl)acetamide.

Molecular Properties

Compound NameN-(1-acetylpiperidin-4-yl)-2-(3-methylphenyl)acetamide
PubChem CID110715006
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC NameN-(1-acetylpiperidin-4-yl)-2-(3-methylphenyl)acetamide
SMILESCC(=O)N1CCC(NC(=O)Cc2cccc(C)c2)CC1
InChIInChI=1S/C16H22N2O2/c1-12-4-3-5-14(10-12)11-16(20)17-15-6-8-18(9-7-15)13(2)19/h3-5,10,15H,6-9,11H2,1-2H3,(H,17,20)
InChIKeyORXBTMXGKGJGSK-UHFFFAOYSA-N
XLogP1.66
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 4-[[2-(3-methylphenyl)acetyl]amino]piperidine-1-carboxylate
CID 110821768
N-[1-(3,3-dimethylbutanoyl)piperidin-4-yl]-2-(3-methylphenyl)acetamide
CID 110822276
N-(1-benzylpiperidin-4-yl)-2-(3-methylphenyl)acetamide
CID 6465155
N-cyclohexyl-2-(3-methylphenyl)acetamide
CID 6467373
1-[4-[2-(3-methylphenyl)ethylamino]piperidin-1-yl]ethanone
CID 55062758
2-(3-methylphenyl)-N-(1-pyrimidin-2-ylpiperidin-4-yl)acetamide
CID 110712574
N-(4-aminocyclohexyl)-2-(3-methylphenyl)acetamide
CID 62387693
N-[1-(2-amino-2-sulfanylideneethyl)piperidin-4-yl]-2-(3-methylphenyl)acetamide
CID 63626474
tert-butyl N-[2-[4-[[2-(3-methylphenyl)acetyl]amino]piperidin-1-yl]-2-oxoethyl]carbamate
CID 108916770
3-(3-methylphenyl)-N-(1-pentanoylpiperidin-4-yl)propanamide
CID 110819545
N-cycloheptyl-1-[2-(3-methylphenyl)acetyl]piperidine-4-carboxamide
CID 113005452
2-(3-methylphenyl)-1-(4-methylpiperidin-1-yl)ethanone
CID 110755251

Frequently Asked Questions

What is the IUPAC name of N-(1-acetylpiperidin-4-yl)-2-(3-methylphenyl)acetamide?
The IUPAC name of N-(1-acetylpiperidin-4-yl)-2-(3-methylphenyl)acetamide (CID 110715006) is N-(1-acetylpiperidin-4-yl)-2-(3-methylphenyl)acetamide.
What is the SMILES notation for N-(1-acetylpiperidin-4-yl)-2-(3-methylphenyl)acetamide?
The canonical SMILES for N-(1-acetylpiperidin-4-yl)-2-(3-methylphenyl)acetamide is CC(=O)N1CCC(NC(=O)Cc2cccc(C)c2)CC1.
What is the InChIKey of N-(1-acetylpiperidin-4-yl)-2-(3-methylphenyl)acetamide?
The InChIKey is ORXBTMXGKGJGSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c1-12-4-3-5-14(10-12)11-16(20)17-15-6-8-18(9-7-15)13(2)19/h3-5,10,15H,6-9,11H2,1-2H3,(H,17,20).
What are the key properties of N-(1-acetylpiperidin-4-yl)-2-(3-methylphenyl)acetamide?
N-(1-acetylpiperidin-4-yl)-2-(3-methylphenyl)acetamide has a molecular weight of 274.36 g/mol, XLogP of 1.66, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-acetylpiperidin-4-yl)-2-(3-methylphenyl)acetamide is sourced from PubChem (CID 110715006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).