1-(cyclohexen-1-yl)-N-propylnon-8-en-2-amine

C18H33N — CID 107009676

IUPAC1-(cyclohexen-1-yl)-N-propylnon-8-en-2-amine
SMILESC=CCCCCCC(CC1=CCCCC1)NCCC
InChIInChI=1S/C18H33N/c1-3-5-6-7-11-14-18(19-15-4-2)16-17-12-9-8-10-13-17/h3,12,18-19H,1,4-11,13-16H2,2H3
InChIKeyHASGAWJBJBKFRJ-UHFFFAOYSA-N
MW263.47 g/mol
LogP5.38
Rot. Bonds11

About 1-(cyclohexen-1-yl)-N-propylnon-8-en-2-amine

1-(cyclohexen-1-yl)-N-propylnon-8-en-2-amine (PubChem CID 107009676) has the molecular formula C18H33N and a molecular weight of 263.47 g/mol. Its IUPAC name is 1-(cyclohexen-1-yl)-N-propylnon-8-en-2-amine.

Molecular Properties

Compound Name1-(cyclohexen-1-yl)-N-propylnon-8-en-2-amine
PubChem CID107009676
Molecular FormulaC18H33N
Molecular Weight263.47 g/mol
Exact Mass263.26
IUPAC Name1-(cyclohexen-1-yl)-N-propylnon-8-en-2-amine
SMILESC=CCCCCCC(CC1=CCCCC1)NCCC
InChIInChI=1S/C18H33N/c1-3-5-6-7-11-14-18(19-15-4-2)16-17-12-9-8-10-13-17/h3,12,18-19H,1,4-11,13-16H2,2H3
InChIKeyHASGAWJBJBKFRJ-UHFFFAOYSA-N
XLogP5.38
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500263.47
LogP ≤ 55.38
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-propylhept-6-en-2-amine
CID 116662062
1-(cyclohexen-1-yl)-N-ethylundecan-2-amine
CID 116661766
1-(cyclohexen-1-yl)-5-methyl-N-propylhex-5-en-2-amine
CID 114475925
1-(cyclohexen-1-yl)-5-phenyl-N-propylpentan-2-amine
CID 116662072
1-(cyclohexen-1-yl)-3-cyclopropyl-N-propylpropan-2-amine
CID 116662141
1-(cyclohexen-1-yl)-5-(oxolan-2-yl)-N-propylpentan-2-amine
CID 116662096
1-(3,4-difluorophenyl)-N-propylnon-8-en-2-amine
CID 107012123
1-methoxy-N-propyldec-9-en-3-amine
CID 107008934
1-hex-5-enylcyclohexene
CID 123683483
N-propyl-1-pyridin-3-ylnon-8-en-2-amine
CID 107009001
N-propylundec-1-en-5-amine
CID 104987530
1-(cyclohexen-1-yl)dodecan-2-amine
CID 116661293

Frequently Asked Questions

What is the IUPAC name of 1-(cyclohexen-1-yl)-N-propylnon-8-en-2-amine?
The IUPAC name of 1-(cyclohexen-1-yl)-N-propylnon-8-en-2-amine (CID 107009676) is 1-(cyclohexen-1-yl)-N-propylnon-8-en-2-amine.
What is the SMILES notation for 1-(cyclohexen-1-yl)-N-propylnon-8-en-2-amine?
The canonical SMILES for 1-(cyclohexen-1-yl)-N-propylnon-8-en-2-amine is C=CCCCCCC(CC1=CCCCC1)NCCC.
What is the InChIKey of 1-(cyclohexen-1-yl)-N-propylnon-8-en-2-amine?
The InChIKey is HASGAWJBJBKFRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H33N/c1-3-5-6-7-11-14-18(19-15-4-2)16-17-12-9-8-10-13-17/h3,12,18-19H,1,4-11,13-16H2,2H3.
What are the key properties of 1-(cyclohexen-1-yl)-N-propylnon-8-en-2-amine?
1-(cyclohexen-1-yl)-N-propylnon-8-en-2-amine has a molecular weight of 263.47 g/mol, XLogP of 5.38, 11 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclohexen-1-yl)-N-propylnon-8-en-2-amine is sourced from PubChem (CID 107009676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).