1-(cyclopenten-1-yl)-N-ethylhexan-1-amine

C13H25N — CID 62080366

IUPAC1-(cyclopenten-1-yl)-N-ethylhexan-1-amine
SMILESCCCCCC(NCC)C1=CCCC1
InChIInChI=1S/C13H25N/c1-3-5-6-11-13(14-4-2)12-9-7-8-10-12/h9,13-14H,3-8,10-11H2,1-2H3
InChIKeySDLAFFCMKYILRV-UHFFFAOYSA-N
MW195.35 g/mol
LogP3.66
Rot. Bonds7

About 1-(cyclopenten-1-yl)-N-ethylhexan-1-amine

1-(cyclopenten-1-yl)-N-ethylhexan-1-amine (PubChem CID 62080366) has the molecular formula C13H25N and a molecular weight of 195.35 g/mol. Its IUPAC name is 1-(cyclopenten-1-yl)-N-ethylhexan-1-amine.

Molecular Properties

Compound Name1-(cyclopenten-1-yl)-N-ethylhexan-1-amine
PubChem CID62080366
Molecular FormulaC13H25N
Molecular Weight195.35 g/mol
Exact Mass195.20
IUPAC Name1-(cyclopenten-1-yl)-N-ethylhexan-1-amine
SMILESCCCCCC(NCC)C1=CCCC1
InChIInChI=1S/C13H25N/c1-3-5-6-11-13(14-4-2)12-9-7-8-10-12/h9,13-14H,3-8,10-11H2,1-2H3
InChIKeySDLAFFCMKYILRV-UHFFFAOYSA-N
XLogP3.66
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.35
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-(cyclohexen-1-yl)-N-ethyloctan-1-amine
CID 63506129
1-(cycloocten-1-yl)-N-ethylhexan-1-amine
CID 106656805
1-(cyclohexen-1-yl)-N-ethyl-4-methylpentan-1-amine
CID 62080150
1-(cycloocten-1-yl)nonylhydrazine
CID 106649991
1-(cyclopenten-1-yl)hexan-1-ol
CID 62078915
1-(cyclohexen-1-yl)-N-ethyl-3-methoxypropan-1-amine
CID 106652652
1-(2,3-dihydrofuran-5-yl)-N-ethyldodecan-1-amine
CID 102653271
1-(cyclopenten-1-yl)-3-cyclopentyl-N-propylpropan-1-amine
CID 55196271
1-(cyclopenten-1-yl)pentan-1-amine
CID 62078864
1-(cyclohepten-1-yl)-N-ethyl-3-pyridin-4-ylpropan-1-amine
CID 106657059
2-(2-chlorophenyl)-1-(cyclopenten-1-yl)-N-ethylethanamine
CID 55034560
1-(cyclohepten-1-yl)heptan-1-amine
CID 114752507

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopenten-1-yl)-N-ethylhexan-1-amine?
The IUPAC name of 1-(cyclopenten-1-yl)-N-ethylhexan-1-amine (CID 62080366) is 1-(cyclopenten-1-yl)-N-ethylhexan-1-amine.
What is the SMILES notation for 1-(cyclopenten-1-yl)-N-ethylhexan-1-amine?
The canonical SMILES for 1-(cyclopenten-1-yl)-N-ethylhexan-1-amine is CCCCCC(NCC)C1=CCCC1.
What is the InChIKey of 1-(cyclopenten-1-yl)-N-ethylhexan-1-amine?
The InChIKey is SDLAFFCMKYILRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N/c1-3-5-6-11-13(14-4-2)12-9-7-8-10-12/h9,13-14H,3-8,10-11H2,1-2H3.
What are the key properties of 1-(cyclopenten-1-yl)-N-ethylhexan-1-amine?
1-(cyclopenten-1-yl)-N-ethylhexan-1-amine has a molecular weight of 195.35 g/mol, XLogP of 3.66, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopenten-1-yl)-N-ethylhexan-1-amine is sourced from PubChem (CID 62080366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).