1-acetyl-N-[2-(2-hydroxyphenyl)ethyl]piperidine-4-carboxamide

C16H22N2O3 — CID 110672379

IUPAC1-acetyl-N-[2-(2-hydroxyphenyl)ethyl]piperidine-4-carboxamide
SMILESCC(=O)N1CCC(C(=O)NCCc2ccccc2O)CC1
InChIInChI=1S/C16H22N2O3/c1-12(19)18-10-7-14(8-11-18)16(21)17-9-6-13-4-2-3-5-15(13)20/h2-5,14,20H,6-11H2,1H3,(H,17,21)
InChIKeyGWONGAZLEVHLGD-UHFFFAOYSA-N
MW290.36 g/mol
LogP1.31
Rot. Bonds4

About 1-acetyl-N-[2-(2-hydroxyphenyl)ethyl]piperidine-4-carboxamide

1-acetyl-N-[2-(2-hydroxyphenyl)ethyl]piperidine-4-carboxamide (PubChem CID 110672379) has the molecular formula C16H22N2O3 and a molecular weight of 290.36 g/mol. Its IUPAC name is 1-acetyl-N-[2-(2-hydroxyphenyl)ethyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-acetyl-N-[2-(2-hydroxyphenyl)ethyl]piperidine-4-carboxamide
PubChem CID110672379
Molecular FormulaC16H22N2O3
Molecular Weight290.36 g/mol
Exact Mass290.16
IUPAC Name1-acetyl-N-[2-(2-hydroxyphenyl)ethyl]piperidine-4-carboxamide
SMILESCC(=O)N1CCC(C(=O)NCCc2ccccc2O)CC1
InChIInChI=1S/C16H22N2O3/c1-12(19)18-10-7-14(8-11-18)16(21)17-9-6-13-4-2-3-5-15(13)20/h2-5,14,20H,6-11H2,1H3,(H,17,21)
InChIKeyGWONGAZLEVHLGD-UHFFFAOYSA-N
XLogP1.31
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.36
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-acetyl-N-[2-(2-fluorophenyl)ethyl]piperidine-4-carboxamide
CID 9268566
1-acetyl-N-[2-(3,4-dimethylphenyl)ethyl]piperidine-4-carboxamide
CID 110795075
1-acetyl-N-[2-(3-acetylphenyl)ethyl]piperidine-4-carboxamide
CID 90729185
1-acetyl-N-(2-benzamidoethyl)piperidine-4-carboxamide
CID 42878771
1-acetyl-N-[2-(furan-2-yl)ethyl]piperidine-4-carboxamide
CID 110745476
1-(cyclopropanecarbonyl)-N-[2-(2-fluorophenyl)ethyl]piperidine-4-carboxamide
CID 39713860
1-(2,2-dimethylpropanoyl)-N-[2-(2-fluorophenyl)ethyl]piperidine-4-carboxamide
CID 51181932
1-acetyl-N-[2-(3,4-dimethoxyphenyl)ethyl]piperidine-4-carboxamide
CID 6465009
ethyl 4-[2-(2-fluorophenyl)ethylcarbamoyl]piperidine-1-carboxylate
CID 39709187
N-benzyl-1-[3-(2-hydroxyphenyl)propanoyl]piperidine-4-carboxamide
CID 31588009
1-acetyl-N-[2-(3-ethyl-4-methoxyphenyl)ethyl]piperidine-4-carboxamide
CID 110795515
1-acetyl-N-[2-(1H-benzimidazol-2-yl)ethyl]piperidine-4-carboxamide
CID 110741848

Frequently Asked Questions

What is the IUPAC name of 1-acetyl-N-[2-(2-hydroxyphenyl)ethyl]piperidine-4-carboxamide?
The IUPAC name of 1-acetyl-N-[2-(2-hydroxyphenyl)ethyl]piperidine-4-carboxamide (CID 110672379) is 1-acetyl-N-[2-(2-hydroxyphenyl)ethyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-acetyl-N-[2-(2-hydroxyphenyl)ethyl]piperidine-4-carboxamide?
The canonical SMILES for 1-acetyl-N-[2-(2-hydroxyphenyl)ethyl]piperidine-4-carboxamide is CC(=O)N1CCC(C(=O)NCCc2ccccc2O)CC1.
What is the InChIKey of 1-acetyl-N-[2-(2-hydroxyphenyl)ethyl]piperidine-4-carboxamide?
The InChIKey is GWONGAZLEVHLGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O3/c1-12(19)18-10-7-14(8-11-18)16(21)17-9-6-13-4-2-3-5-15(13)20/h2-5,14,20H,6-11H2,1H3,(H,17,21).
What are the key properties of 1-acetyl-N-[2-(2-hydroxyphenyl)ethyl]piperidine-4-carboxamide?
1-acetyl-N-[2-(2-hydroxyphenyl)ethyl]piperidine-4-carboxamide has a molecular weight of 290.36 g/mol, XLogP of 1.31, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-acetyl-N-[2-(2-hydroxyphenyl)ethyl]piperidine-4-carboxamide is sourced from PubChem (CID 110672379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).