2-cyano-N-(2-cyclopentylethyl)-N-methylacetamide

C11H18N2O — CID 115173391

IUPAC2-cyano-N-(2-cyclopentylethyl)-N-methylacetamide
SMILESCN(CCC1CCCC1)C(=O)CC#N
InChIInChI=1S/C11H18N2O/c1-13(11(14)6-8-12)9-7-10-4-2-3-5-10/h10H,2-7,9H2,1H3
InChIKeyCZNSJWHEYLFPDT-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.94
Rot. Bonds4

About 2-cyano-N-(2-cyclopentylethyl)-N-methylacetamide

2-cyano-N-(2-cyclopentylethyl)-N-methylacetamide (PubChem CID 115173391) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is 2-cyano-N-(2-cyclopentylethyl)-N-methylacetamide.

Molecular Properties

Compound Name2-cyano-N-(2-cyclopentylethyl)-N-methylacetamide
PubChem CID115173391
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name2-cyano-N-(2-cyclopentylethyl)-N-methylacetamide
SMILESCN(CCC1CCCC1)C(=O)CC#N
InChIInChI=1S/C11H18N2O/c1-13(11(14)6-8-12)9-7-10-4-2-3-5-10/h10H,2-7,9H2,1H3
InChIKeyCZNSJWHEYLFPDT-UHFFFAOYSA-N
XLogP1.94
TPSA44.10 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-cyclopentylethyl)-N-methyl-2-sulfanylacetamide
CID 115167537
N-(2-cyclopentylethyl)-N-methyl-2-pyrrolidin-3-ylacetamide
CID 115160413
N-(2-cyclohexylethyl)-4-hydroxy-N-methylbutanamide
CID 115163166
3-chloro-N-(2-cyclobutylethyl)-N-methylpropanamide
CID 115162722
4-[2-cyclohexylethyl(methyl)amino]-2,2-dimethyl-4-oxobutanoic acid
CID 115165295
1-(2-cyclopentylethyl)-1,3-dimethylurea
CID 115169542
N-(2-cyclopropylethyl)-N-methylacetamide
CID 130751028
4-amino-N-(2-cyclohexylethyl)-N,4-dimethylpentanamide
CID 115157638
2-cyclobutylethyl(methyl)carbamothioic S-acid
CID 115170497
1-(2-cyclobutylethyl)-1-methylurea
CID 115168733
1,3-bis(2-cyclopentylethyl)-1,3-dimethylthiourea
CID 18716766
2-cyano-N-[2-(diethylamino)ethyl]-N-methylacetamide
CID 165346740

Frequently Asked Questions

What is the IUPAC name of 2-cyano-N-(2-cyclopentylethyl)-N-methylacetamide?
The IUPAC name of 2-cyano-N-(2-cyclopentylethyl)-N-methylacetamide (CID 115173391) is 2-cyano-N-(2-cyclopentylethyl)-N-methylacetamide.
What is the SMILES notation for 2-cyano-N-(2-cyclopentylethyl)-N-methylacetamide?
The canonical SMILES for 2-cyano-N-(2-cyclopentylethyl)-N-methylacetamide is CN(CCC1CCCC1)C(=O)CC#N.
What is the InChIKey of 2-cyano-N-(2-cyclopentylethyl)-N-methylacetamide?
The InChIKey is CZNSJWHEYLFPDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-13(11(14)6-8-12)9-7-10-4-2-3-5-10/h10H,2-7,9H2,1H3.
What are the key properties of 2-cyano-N-(2-cyclopentylethyl)-N-methylacetamide?
2-cyano-N-(2-cyclopentylethyl)-N-methylacetamide has a molecular weight of 194.28 g/mol, XLogP of 1.94, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyano-N-(2-cyclopentylethyl)-N-methylacetamide is sourced from PubChem (CID 115173391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).