N-(4-cyanophenyl)-2-piperidin-1-ylacetamide

C14H17N3O — CID 2697414

IUPACN-(4-cyanophenyl)-2-piperidin-1-ylacetamide
SMILESN#Cc1ccc(NC(=O)CN2CCCCC2)cc1
InChIInChI=1S/C14H17N3O/c15-10-12-4-6-13(7-5-12)16-14(18)11-17-8-2-1-3-9-17/h4-7H,1-3,8-9,11H2,(H,16,18)
InChIKeyGJWZMKHSDXTPCA-UHFFFAOYSA-N
MW243.31 g/mol
LogP1.98
Rot. Bonds3

About N-(4-cyanophenyl)-2-piperidin-1-ylacetamide

N-(4-cyanophenyl)-2-piperidin-1-ylacetamide (PubChem CID 2697414) has the molecular formula C14H17N3O and a molecular weight of 243.31 g/mol. Its IUPAC name is N-(4-cyanophenyl)-2-piperidin-1-ylacetamide.

Molecular Properties

Compound NameN-(4-cyanophenyl)-2-piperidin-1-ylacetamide
PubChem CID2697414
Molecular FormulaC14H17N3O
Molecular Weight243.31 g/mol
Exact Mass243.14
IUPAC NameN-(4-cyanophenyl)-2-piperidin-1-ylacetamide
SMILESN#Cc1ccc(NC(=O)CN2CCCCC2)cc1
InChIInChI=1S/C14H17N3O/c15-10-12-4-6-13(7-5-12)16-14(18)11-17-8-2-1-3-9-17/h4-7H,1-3,8-9,11H2,(H,16,18)
InChIKeyGJWZMKHSDXTPCA-UHFFFAOYSA-N
XLogP1.98
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 ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(azocan-1-yl)-N-(4-cyanophenyl)propanamide
CID 28801310
N-(4-cyanophenyl)-2-(3-hydroxypiperidin-1-yl)acetamide
CID 60642377
N-[4-(cyanomethyl)phenyl]-2-piperidin-1-ylacetamide
CID 9032808
N-(4-cyanophenyl)-2-[4-(hydroxymethyl)piperidin-1-yl]acetamide
CID 43246133
N-(4-cyanophenyl)-2-(3,4-dihydroxypyrrolidin-1-yl)acetamide
CID 106669426
3-cyano-5-fluoro-N-[4-[(2-piperidin-1-ylacetyl)amino]phenyl]benzamide
CID 131900746
N-(4-bromophenyl)-2-[4-[(4-cyanophenyl)methyl]-1,4-diazepan-1-yl]acetamide
CID 16598170
N-(4-cyanophenyl)-2-(3-ethylpiperidin-1-yl)acetamide
CID 43430359
N-[4-[[2-(azepan-1-yl)acetyl]amino]phenyl]propanamide
CID 54814408
2-(4-benzoylpiperazin-1-yl)-N-(4-cyanophenyl)acetamide
CID 9223598
N-(4-cyanophenyl)-2-[4-(methylaminomethyl)piperidin-1-yl]acetamide
CID 63248740
2-[4-[(4-cyanophenyl)methyl]-1,4-diazepan-1-yl]-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide
CID 16598180

Frequently Asked Questions

What is the IUPAC name of N-(4-cyanophenyl)-2-piperidin-1-ylacetamide?
The IUPAC name of N-(4-cyanophenyl)-2-piperidin-1-ylacetamide (CID 2697414) is N-(4-cyanophenyl)-2-piperidin-1-ylacetamide.
What is the SMILES notation for N-(4-cyanophenyl)-2-piperidin-1-ylacetamide?
The canonical SMILES for N-(4-cyanophenyl)-2-piperidin-1-ylacetamide is N#Cc1ccc(NC(=O)CN2CCCCC2)cc1.
What is the InChIKey of N-(4-cyanophenyl)-2-piperidin-1-ylacetamide?
The InChIKey is GJWZMKHSDXTPCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O/c15-10-12-4-6-13(7-5-12)16-14(18)11-17-8-2-1-3-9-17/h4-7H,1-3,8-9,11H2,(H,16,18).
What are the key properties of N-(4-cyanophenyl)-2-piperidin-1-ylacetamide?
N-(4-cyanophenyl)-2-piperidin-1-ylacetamide has a molecular weight of 243.31 g/mol, XLogP of 1.98, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyanophenyl)-2-piperidin-1-ylacetamide is sourced from PubChem (CID 2697414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).