1-cyclopentyl-N-ethyloct-7-en-3-amine

C15H29N — CID 104986890

IUPAC1-cyclopentyl-N-ethyloct-7-en-3-amine
SMILESC=CCCCC(CCC1CCCC1)NCC
InChIInChI=1S/C15H29N/c1-3-5-6-11-15(16-4-2)13-12-14-9-7-8-10-14/h3,14-16H,1,4-13H2,2H3
InChIKeyVTWYHNHHTHVULC-UHFFFAOYSA-N
MW223.40 g/mol
LogP4.29
Rot. Bonds9

About 1-cyclopentyl-N-ethyloct-7-en-3-amine

1-cyclopentyl-N-ethyloct-7-en-3-amine (PubChem CID 104986890) has the molecular formula C15H29N and a molecular weight of 223.40 g/mol. Its IUPAC name is 1-cyclopentyl-N-ethyloct-7-en-3-amine.

Molecular Properties

Compound Name1-cyclopentyl-N-ethyloct-7-en-3-amine
PubChem CID104986890
Molecular FormulaC15H29N
Molecular Weight223.40 g/mol
Exact Mass223.23
IUPAC Name1-cyclopentyl-N-ethyloct-7-en-3-amine
SMILESC=CCCCC(CCC1CCCC1)NCC
InChIInChI=1S/C15H29N/c1-3-5-6-11-15(16-4-2)13-12-14-9-7-8-10-14/h3,14-16H,1,4-13H2,2H3
InChIKeyVTWYHNHHTHVULC-UHFFFAOYSA-N
XLogP4.29
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.40
LogP ≤ 54.29
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

Ethylamine, N-allyl-2-(2-cyclopentenyl)-1-methyl-
CID 49661
Ethylamine, 2-(2-cyclopentenyl)-N,1-dimethyl-
CID 49662
N-[4-fluoro-4-methyl-2-(2-methylcyclopentyl)-3-propylhexyl]-6,8-dimethyldec-9-en-2-amine
CID 155055595
cis-(1S,3R)-3-fluoro-N-methyl-2-(2-methylbut-3-enyl)cyclohexan-1-amine
CID 163693207
N-but-3-enyl-4-fluoro-2-methylcyclopentan-1-amine
CID 166995828
2-(5-fluorohexan-2-yl)-2,3-dihydro-1H-pyrrole
CID 167204966
N-[(2S)-2-ethylbut-3-enyl]nonan-1-amine
CID 11031535
trans-2,5-Bis-(1,1-dimethylallyl)-pyrrolidine
CID 11127485
2-Allyl-2-methylazepane
CID 12765139
2,3-Bis(1-methylallyl) pyrrolidine
CID 21157860
(2S,3R,7S)-7-ethyl-3-methyl-2-prop-2-enylazecane
CID 46218591
N-(2-methylpropyl)-2-prop-2-enylcyclohexan-1-amine
CID 85614646

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-N-ethyloct-7-en-3-amine?
The IUPAC name of 1-cyclopentyl-N-ethyloct-7-en-3-amine (CID 104986890) is 1-cyclopentyl-N-ethyloct-7-en-3-amine.
What is the SMILES notation for 1-cyclopentyl-N-ethyloct-7-en-3-amine?
The canonical SMILES for 1-cyclopentyl-N-ethyloct-7-en-3-amine is C=CCCCC(CCC1CCCC1)NCC.
What is the InChIKey of 1-cyclopentyl-N-ethyloct-7-en-3-amine?
The InChIKey is VTWYHNHHTHVULC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N/c1-3-5-6-11-15(16-4-2)13-12-14-9-7-8-10-14/h3,14-16H,1,4-13H2,2H3.
What are the key properties of 1-cyclopentyl-N-ethyloct-7-en-3-amine?
1-cyclopentyl-N-ethyloct-7-en-3-amine has a molecular weight of 223.40 g/mol, XLogP of 4.29, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-ethyloct-7-en-3-amine is sourced from PubChem (CID 104986890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).