3-cyclopentyl-N,N-dipentylpropanamide

C18H35NO — CID 4248024

IUPAC3-cyclopentyl-N,N-dipentylpropanamide
SMILESCCCCCN(CCCCC)C(=O)CCC1CCCC1
InChIInChI=1S/C18H35NO/c1-3-5-9-15-19(16-10-6-4-2)18(20)14-13-17-11-7-8-12-17/h17H,3-16H2,1-2H3
InChIKeyKLJJGRLSOQYCKL-UHFFFAOYSA-N
MW281.48 g/mol
LogP5.17
Rot. Bonds11

About 3-cyclopentyl-N,N-dipentylpropanamide

3-cyclopentyl-N,N-dipentylpropanamide (PubChem CID 4248024) has the molecular formula C18H35NO and a molecular weight of 281.48 g/mol. Its IUPAC name is 3-cyclopentyl-N,N-dipentylpropanamide.

Molecular Properties

Compound Name3-cyclopentyl-N,N-dipentylpropanamide
PubChem CID4248024
Molecular FormulaC18H35NO
Molecular Weight281.48 g/mol
Exact Mass281.27
IUPAC Name3-cyclopentyl-N,N-dipentylpropanamide
SMILESCCCCCN(CCCCC)C(=O)CCC1CCCC1
InChIInChI=1S/C18H35NO/c1-3-5-9-15-19(16-10-6-4-2)18(20)14-13-17-11-7-8-12-17/h17H,3-16H2,1-2H3
InChIKeyKLJJGRLSOQYCKL-UHFFFAOYSA-N
XLogP5.17
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500281.48
LogP ≤ 55.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

3-cyclopentyl-N,N-diheptylpropanamide
CID 532988
N,N-dibutyl-2-cyclopentylacetamide
CID 13315634
2-cyclohexyl-N-heptyl-N-(5-hydroxypentyl)acetamide
CID 10314256
N-(cyanomethyl)-3-cyclohexyl-N-propylpropanamide
CID 61224500
N,N-di(undecyl)butanamide
CID 533369
N,N-di(nonyl)butanamide
CID 533367
N,N-di(nonyl)octanamide
CID 533141
N,N,N',N'-tetraoctylhexanediamide
CID 18938545
N,N-di(undecyl)pentanamide
CID 532896
N,N-dioctyltetradecanamide
CID 169083302
1-cyclopentylpentadecan-3-one
CID 114969105
3-cyclopentyl-N-(2-hydroxyethyl)-N-(2-methoxyethyl)propanamide
CID 113339851

Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-N,N-dipentylpropanamide?
The IUPAC name of 3-cyclopentyl-N,N-dipentylpropanamide (CID 4248024) is 3-cyclopentyl-N,N-dipentylpropanamide.
What is the SMILES notation for 3-cyclopentyl-N,N-dipentylpropanamide?
The canonical SMILES for 3-cyclopentyl-N,N-dipentylpropanamide is CCCCCN(CCCCC)C(=O)CCC1CCCC1.
What is the InChIKey of 3-cyclopentyl-N,N-dipentylpropanamide?
The InChIKey is KLJJGRLSOQYCKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35NO/c1-3-5-9-15-19(16-10-6-4-2)18(20)14-13-17-11-7-8-12-17/h17H,3-16H2,1-2H3.
What are the key properties of 3-cyclopentyl-N,N-dipentylpropanamide?
3-cyclopentyl-N,N-dipentylpropanamide has a molecular weight of 281.48 g/mol, XLogP of 5.17, 11 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-N,N-dipentylpropanamide is sourced from PubChem (CID 4248024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).