1-phenacylpiperidine-2-carboxamide

C14H18N2O2 — CID 60681003

IUPAC1-phenacylpiperidine-2-carboxamide
SMILESNC(=O)C1CCCCN1CC(=O)c1ccccc1
InChIInChI=1S/C14H18N2O2/c15-14(18)12-8-4-5-9-16(12)10-13(17)11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10H2,(H2,15,18)
InChIKeyBNYJWSKMTKZOGA-UHFFFAOYSA-N
MW246.31 g/mol
LogP1.21
Rot. Bonds4

About 1-phenacylpiperidine-2-carboxamide

1-phenacylpiperidine-2-carboxamide (PubChem CID 60681003) has the molecular formula C14H18N2O2 and a molecular weight of 246.31 g/mol. Its IUPAC name is 1-phenacylpiperidine-2-carboxamide.

Molecular Properties

Compound Name1-phenacylpiperidine-2-carboxamide
PubChem CID60681003
Molecular FormulaC14H18N2O2
Molecular Weight246.31 g/mol
Exact Mass246.14
IUPAC Name1-phenacylpiperidine-2-carboxamide
SMILESNC(=O)C1CCCCN1CC(=O)c1ccccc1
InChIInChI=1S/C14H18N2O2/c15-14(18)12-8-4-5-9-16(12)10-13(17)11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10H2,(H2,15,18)
InChIKeyBNYJWSKMTKZOGA-UHFFFAOYSA-N
XLogP1.21
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(4-methylphenyl)-2-oxoethyl]piperidine-2-carboxamide
CID 60680985
1-[2-(4-methylsulfanylphenyl)-2-oxoethyl]piperidine-2-carboxamide
CID 60680989
(2S)-1-phenacylpyrrolidine-2-carboximidamide
CID 58516261
1-(2-oxo-2-thiophen-2-ylethyl)piperidine-2-carboxamide
CID 60680965
1-[2-(2-ethoxyphenyl)-2-oxoethyl]piperidine-2-carboxamide
CID 62037237
2-(2-ethylazepan-1-yl)-1-phenylethanone
CID 104690677
1-phenyl-2-[2-(4-phenylphenyl)piperidin-1-yl]ethanone
CID 18423529
(2R)-1-[2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl]piperidine-2-carboxamide
CID 41075375
1-(3-oxo-3-phenylpropyl)piperidine-2-carboxylic acid
CID 22225856
1-[2-oxo-2-(4-propan-2-ylphenyl)ethyl]piperidine-2-carboxylic acid
CID 82224047
1-[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]piperidine-2-carboxamide
CID 60681090
1-[2-(N-cyclohexylanilino)-2-oxoethyl]pyrrolidine-2-carboxamide
CID 57166210

Frequently Asked Questions

What is the IUPAC name of 1-phenacylpiperidine-2-carboxamide?
The IUPAC name of 1-phenacylpiperidine-2-carboxamide (CID 60681003) is 1-phenacylpiperidine-2-carboxamide.
What is the SMILES notation for 1-phenacylpiperidine-2-carboxamide?
The canonical SMILES for 1-phenacylpiperidine-2-carboxamide is NC(=O)C1CCCCN1CC(=O)c1ccccc1.
What is the InChIKey of 1-phenacylpiperidine-2-carboxamide?
The InChIKey is BNYJWSKMTKZOGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2/c15-14(18)12-8-4-5-9-16(12)10-13(17)11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10H2,(H2,15,18).
What are the key properties of 1-phenacylpiperidine-2-carboxamide?
1-phenacylpiperidine-2-carboxamide has a molecular weight of 246.31 g/mol, XLogP of 1.21, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenacylpiperidine-2-carboxamide is sourced from PubChem (CID 60681003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).