2-(4-cyanopiperidin-1-yl)-N-phenylacetamide

C14H17N3O — CID 48940732

IUPAC2-(4-cyanopiperidin-1-yl)-N-phenylacetamide
SMILESN#CC1CCN(CC(=O)Nc2ccccc2)CC1
InChIInChI=1S/C14H17N3O/c15-10-12-6-8-17(9-7-12)11-14(18)16-13-4-2-1-3-5-13/h1-5,12H,6-9,11H2,(H,16,18)
InChIKeyQYHQKRHCMJQWDW-UHFFFAOYSA-N
MW243.31 g/mol
LogP1.86
Rot. Bonds3

About 2-(4-cyanopiperidin-1-yl)-N-phenylacetamide

2-(4-cyanopiperidin-1-yl)-N-phenylacetamide (PubChem CID 48940732) has the molecular formula C14H17N3O and a molecular weight of 243.31 g/mol. Its IUPAC name is 2-(4-cyanopiperidin-1-yl)-N-phenylacetamide.

Molecular Properties

Compound Name2-(4-cyanopiperidin-1-yl)-N-phenylacetamide
PubChem CID48940732
Molecular FormulaC14H17N3O
Molecular Weight243.31 g/mol
Exact Mass243.14
IUPAC Name2-(4-cyanopiperidin-1-yl)-N-phenylacetamide
SMILESN#CC1CCN(CC(=O)Nc2ccccc2)CC1
InChIInChI=1S/C14H17N3O/c15-10-12-6-8-17(9-7-12)11-14(18)16-13-4-2-1-3-5-13/h1-5,12H,6-9,11H2,(H,16,18)
InChIKeyQYHQKRHCMJQWDW-UHFFFAOYSA-N
XLogP1.86
TPSA56.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-hydroxypiperidin-1-yl)-N-phenylacetamide
CID 39902294
2-(4-ethoxypiperidin-1-yl)-N-phenylacetamide
CID 47358518
2-[4-[acetyl(ethyl)amino]piperidin-1-yl]-N-phenylacetamide
CID 70256212
2-(4-cyanopiperidin-1-yl)-N-(2,5-dichlorophenyl)acetamide
CID 48940747
2-[4-(hydroxymethyl)piperidin-1-yl]-N-(4-phenylphenyl)acetamide
CID 60510320
1-[2-(4-fluoroanilino)-2-oxoethyl]-N-phenylpiperidine-4-carboxamide
CID 9134233
N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-2,2-dimethylpropanamide
CID 3220730
N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]cyclobutanecarboxamide
CID 16589812
4-amino-N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]butanamide;dihydrochloride
CID 119840358
2-[13-(2-anilino-2-oxoethyl)-1,4,10-trioxa-7,13-diazacyclopentadec-7-yl]-N-phenylacetamide
CID 649229
N-(4-hydroxyphenyl)-2-(4-phenylpiperidin-1-yl)acetamide
CID 47021714
N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]cyclohexanecarboxamide
CID 3220728

Frequently Asked Questions

What is the IUPAC name of 2-(4-cyanopiperidin-1-yl)-N-phenylacetamide?
The IUPAC name of 2-(4-cyanopiperidin-1-yl)-N-phenylacetamide (CID 48940732) is 2-(4-cyanopiperidin-1-yl)-N-phenylacetamide.
What is the SMILES notation for 2-(4-cyanopiperidin-1-yl)-N-phenylacetamide?
The canonical SMILES for 2-(4-cyanopiperidin-1-yl)-N-phenylacetamide is N#CC1CCN(CC(=O)Nc2ccccc2)CC1.
What is the InChIKey of 2-(4-cyanopiperidin-1-yl)-N-phenylacetamide?
The InChIKey is QYHQKRHCMJQWDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O/c15-10-12-6-8-17(9-7-12)11-14(18)16-13-4-2-1-3-5-13/h1-5,12H,6-9,11H2,(H,16,18).
What are the key properties of 2-(4-cyanopiperidin-1-yl)-N-phenylacetamide?
2-(4-cyanopiperidin-1-yl)-N-phenylacetamide has a molecular weight of 243.31 g/mol, XLogP of 1.86, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyanopiperidin-1-yl)-N-phenylacetamide is sourced from PubChem (CID 48940732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).