N-(1-acetylpiperidin-4-yl)-N-(2,4-dimethylphenyl)acetamide

C17H24N2O2 — CID 140969567

IUPACN-(1-acetylpiperidin-4-yl)-N-(2,4-dimethylphenyl)acetamide
SMILESCC(=O)N1CCC(N(C(C)=O)c2ccc(C)cc2C)CC1
InChIInChI=1S/C17H24N2O2/c1-12-5-6-17(13(2)11-12)19(15(4)21)16-7-9-18(10-8-16)14(3)20/h5-6,11,16H,7-10H2,1-4H3
InChIKeyOZCGXBHSULYGSR-UHFFFAOYSA-N
MW288.39 g/mol
LogP2.67
Rot. Bonds2

About N-(1-acetylpiperidin-4-yl)-N-(2,4-dimethylphenyl)acetamide

N-(1-acetylpiperidin-4-yl)-N-(2,4-dimethylphenyl)acetamide (PubChem CID 140969567) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is N-(1-acetylpiperidin-4-yl)-N-(2,4-dimethylphenyl)acetamide.

Molecular Properties

Compound NameN-(1-acetylpiperidin-4-yl)-N-(2,4-dimethylphenyl)acetamide
PubChem CID140969567
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC NameN-(1-acetylpiperidin-4-yl)-N-(2,4-dimethylphenyl)acetamide
SMILESCC(=O)N1CCC(N(C(C)=O)c2ccc(C)cc2C)CC1
InChIInChI=1S/C17H24N2O2/c1-12-5-6-17(13(2)11-12)19(15(4)21)16-7-9-18(10-8-16)14(3)20/h5-6,11,16H,7-10H2,1-4H3
InChIKeyOZCGXBHSULYGSR-UHFFFAOYSA-N
XLogP2.67
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1-acetylpiperidin-4-yl)-N-(2,4-dimethylphenyl)acetamide?
The IUPAC name of N-(1-acetylpiperidin-4-yl)-N-(2,4-dimethylphenyl)acetamide (CID 140969567) is N-(1-acetylpiperidin-4-yl)-N-(2,4-dimethylphenyl)acetamide.
What is the SMILES notation for N-(1-acetylpiperidin-4-yl)-N-(2,4-dimethylphenyl)acetamide?
The canonical SMILES for N-(1-acetylpiperidin-4-yl)-N-(2,4-dimethylphenyl)acetamide is CC(=O)N1CCC(N(C(C)=O)c2ccc(C)cc2C)CC1.
What is the InChIKey of N-(1-acetylpiperidin-4-yl)-N-(2,4-dimethylphenyl)acetamide?
The InChIKey is OZCGXBHSULYGSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-12-5-6-17(13(2)11-12)19(15(4)21)16-7-9-18(10-8-16)14(3)20/h5-6,11,16H,7-10H2,1-4H3.
What are the key properties of N-(1-acetylpiperidin-4-yl)-N-(2,4-dimethylphenyl)acetamide?
N-(1-acetylpiperidin-4-yl)-N-(2,4-dimethylphenyl)acetamide has a molecular weight of 288.39 g/mol, XLogP of 2.67, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-acetylpiperidin-4-yl)-N-(2,4-dimethylphenyl)acetamide is sourced from PubChem (CID 140969567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).