N-(4-cyanophenyl)-2-cyclopentyl-N-methylacetamide

C15H18N2O — CID 55141963

IUPACN-(4-cyanophenyl)-2-cyclopentyl-N-methylacetamide
SMILESCN(C(=O)CC1CCCC1)c1ccc(C#N)cc1
InChIInChI=1S/C15H18N2O/c1-17(14-8-6-13(11-16)7-9-14)15(18)10-12-4-2-3-5-12/h6-9,12H,2-5,10H2,1H3
InChIKeyJCQKXRXIWPDAQN-UHFFFAOYSA-N
MW242.32 g/mol
LogP3.10
Rot. Bonds3

About N-(4-cyanophenyl)-2-cyclopentyl-N-methylacetamide

N-(4-cyanophenyl)-2-cyclopentyl-N-methylacetamide (PubChem CID 55141963) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is N-(4-cyanophenyl)-2-cyclopentyl-N-methylacetamide.

Molecular Properties

Compound NameN-(4-cyanophenyl)-2-cyclopentyl-N-methylacetamide
PubChem CID55141963
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC NameN-(4-cyanophenyl)-2-cyclopentyl-N-methylacetamide
SMILESCN(C(=O)CC1CCCC1)c1ccc(C#N)cc1
InChIInChI=1S/C15H18N2O/c1-17(14-8-6-13(11-16)7-9-14)15(18)10-12-4-2-3-5-12/h6-9,12H,2-5,10H2,1H3
InChIKeyJCQKXRXIWPDAQN-UHFFFAOYSA-N
XLogP3.10
TPSA44.10 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 53.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclopentyl-N-(4-hydroxyphenyl)-N-methylacetamide
CID 28738996
2-cyclohexyl-N-(4-hydroxyphenyl)-N-methylacetamide
CID 43210198
2-(2-bicyclo[2.2.1]heptanyl)-N-(4-cyanophenyl)-N-methylacetamide
CID 62982751
N-(4-cyanophenyl)-N-methyl-3-piperidin-4-ylpropanamide
CID 62982663
2-cyclopentyl-N-(3,4-dimethylphenyl)-N-methylacetamide
CID 123790162
2-bromo-N-(4-cyanophenyl)-N-methylacetamide
CID 63679745
N-(4-carbamothioylphenyl)-2-cyclohexyl-N-methylacetamide
CID 62970842
1-(4-cyanophenyl)-3-cyclohexyl-1-methylurea
CID 62981204
N-[1-(2-aminoethyl)-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-4-cyanobenzamide
CID 58742894
N-[1-[2-[acetyl(methyl)amino]ethyl]-5-[(2-cyclopentylacetyl)-methylamino]benzimidazol-2-yl]-4-cyanobenzamide
CID 58742545
2-(4-cyanophenyl)-N-(cyclobutylmethyl)-N-methylacetamide
CID 63611364
N-[2-[(4-cyanophenyl)carbamoylamino]-1-(3-hydroxy-3-methylbutyl)benzimidazol-5-yl]-2-cyclopentyl-N-methylacetamide
CID 71259313

Frequently Asked Questions

What is the IUPAC name of N-(4-cyanophenyl)-2-cyclopentyl-N-methylacetamide?
The IUPAC name of N-(4-cyanophenyl)-2-cyclopentyl-N-methylacetamide (CID 55141963) is N-(4-cyanophenyl)-2-cyclopentyl-N-methylacetamide.
What is the SMILES notation for N-(4-cyanophenyl)-2-cyclopentyl-N-methylacetamide?
The canonical SMILES for N-(4-cyanophenyl)-2-cyclopentyl-N-methylacetamide is CN(C(=O)CC1CCCC1)c1ccc(C#N)cc1.
What is the InChIKey of N-(4-cyanophenyl)-2-cyclopentyl-N-methylacetamide?
The InChIKey is JCQKXRXIWPDAQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-17(14-8-6-13(11-16)7-9-14)15(18)10-12-4-2-3-5-12/h6-9,12H,2-5,10H2,1H3.
What are the key properties of N-(4-cyanophenyl)-2-cyclopentyl-N-methylacetamide?
N-(4-cyanophenyl)-2-cyclopentyl-N-methylacetamide has a molecular weight of 242.32 g/mol, XLogP of 3.10, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyanophenyl)-2-cyclopentyl-N-methylacetamide is sourced from PubChem (CID 55141963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).