2-cyano-N-[2-(cyclopenten-1-yl)ethyl]-2-propylpentanamide

C16H26N2O — CID 106173529

IUPAC2-cyano-N-[2-(cyclopenten-1-yl)ethyl]-2-propylpentanamide
SMILESCCCC(C#N)(CCC)C(=O)NCCC1=CCCC1
InChIInChI=1S/C16H26N2O/c1-3-10-16(13-17,11-4-2)15(19)18-12-9-14-7-5-6-8-14/h7H,3-6,8-12H2,1-2H3,(H,18,19)
InChIKeyFERLIUAXQSRCGM-UHFFFAOYSA-N
MW262.40 g/mol
LogP3.71
Rot. Bonds8

About 2-cyano-N-[2-(cyclopenten-1-yl)ethyl]-2-propylpentanamide

2-cyano-N-[2-(cyclopenten-1-yl)ethyl]-2-propylpentanamide (PubChem CID 106173529) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 2-cyano-N-[2-(cyclopenten-1-yl)ethyl]-2-propylpentanamide.

Molecular Properties

Compound Name2-cyano-N-[2-(cyclopenten-1-yl)ethyl]-2-propylpentanamide
PubChem CID106173529
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name2-cyano-N-[2-(cyclopenten-1-yl)ethyl]-2-propylpentanamide
SMILESCCCC(C#N)(CCC)C(=O)NCCC1=CCCC1
InChIInChI=1S/C16H26N2O/c1-3-10-16(13-17,11-4-2)15(19)18-12-9-14-7-5-6-8-14/h7H,3-6,8-12H2,1-2H3,(H,18,19)
InChIKeyFERLIUAXQSRCGM-UHFFFAOYSA-N
XLogP3.71
TPSA52.89 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-cyano-N-[2-(cyclohexen-1-yl)ethyl]-2-methylpropanamide
CID 55028534
N-[2-(cyclopenten-1-yl)ethyl]prop-2-enamide
CID 107363227
3-amino-N-[2-(cyclohexen-1-yl)ethyl]-2,2,3-trimethylbutanamide
CID 65264692
N-[2-(cyclopenten-1-yl)ethyl]-2-ethoxyacetamide
CID 103842215
2-[2-(cyclopenten-1-yl)ethylcarbamoylamino]-2-methylbutanoic acid
CID 106178401
1-cyano-N-[2-(cyclopenten-1-yl)ethyl]cyclohexane-1-carboxamide
CID 113330028
N-[2-(cyclohexen-1-yl)ethyl]-2-ethylbutanamide
CID 5121995
5-[2-(cyclopenten-1-yl)ethylamino]-2,2-dimethylpentanenitrile
CID 106174040
N-butan-2-yl-N'-[2-(cyclohexen-1-yl)ethyl]-2,2-dimethylpropanediamide
CID 108958156
N-[2-(cyclopenten-1-yl)ethyl]-3-propylpyrrolidine-3-carboxamide
CID 114154033
N-[2-(cyclohexen-1-yl)ethyl]-2-(propylamino)pyrimidine-5-carboxamide
CID 109246675
2-cyano-N-(3-propoxypropyl)-2-propylpentanamide
CID 82941499

Frequently Asked Questions

What is the IUPAC name of 2-cyano-N-[2-(cyclopenten-1-yl)ethyl]-2-propylpentanamide?
The IUPAC name of 2-cyano-N-[2-(cyclopenten-1-yl)ethyl]-2-propylpentanamide (CID 106173529) is 2-cyano-N-[2-(cyclopenten-1-yl)ethyl]-2-propylpentanamide.
What is the SMILES notation for 2-cyano-N-[2-(cyclopenten-1-yl)ethyl]-2-propylpentanamide?
The canonical SMILES for 2-cyano-N-[2-(cyclopenten-1-yl)ethyl]-2-propylpentanamide is CCCC(C#N)(CCC)C(=O)NCCC1=CCCC1.
What is the InChIKey of 2-cyano-N-[2-(cyclopenten-1-yl)ethyl]-2-propylpentanamide?
The InChIKey is FERLIUAXQSRCGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-3-10-16(13-17,11-4-2)15(19)18-12-9-14-7-5-6-8-14/h7H,3-6,8-12H2,1-2H3,(H,18,19).
What are the key properties of 2-cyano-N-[2-(cyclopenten-1-yl)ethyl]-2-propylpentanamide?
2-cyano-N-[2-(cyclopenten-1-yl)ethyl]-2-propylpentanamide has a molecular weight of 262.40 g/mol, XLogP of 3.71, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyano-N-[2-(cyclopenten-1-yl)ethyl]-2-propylpentanamide is sourced from PubChem (CID 106173529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).