1-[2-(cyclohexen-1-yl)ethyl]cyclohexan-1-amine

C14H25N — CID 13381213

IUPAC1-[2-(cyclohexen-1-yl)ethyl]cyclohexan-1-amine
SMILESNC1(CCC2=CCCCC2)CCCCC1
InChIInChI=1S/C14H25N/c15-14(10-5-2-6-11-14)12-9-13-7-3-1-4-8-13/h7H,1-6,8-12,15H2
InChIKeyAASFNLQJVANNNE-UHFFFAOYSA-N
MW207.36 g/mol
LogP3.93
Rot. Bonds3

About 1-[2-(cyclohexen-1-yl)ethyl]cyclohexan-1-amine

1-[2-(cyclohexen-1-yl)ethyl]cyclohexan-1-amine (PubChem CID 13381213) has the molecular formula C14H25N and a molecular weight of 207.36 g/mol. Its IUPAC name is 1-[2-(cyclohexen-1-yl)ethyl]cyclohexan-1-amine.

Molecular Properties

Compound Name1-[2-(cyclohexen-1-yl)ethyl]cyclohexan-1-amine
PubChem CID13381213
Molecular FormulaC14H25N
Molecular Weight207.36 g/mol
Exact Mass207.20
IUPAC Name1-[2-(cyclohexen-1-yl)ethyl]cyclohexan-1-amine
SMILESNC1(CCC2=CCCCC2)CCCCC1
InChIInChI=1S/C14H25N/c15-14(10-5-2-6-11-14)12-9-13-7-3-1-4-8-13/h7H,1-6,8-12,15H2
InChIKeyAASFNLQJVANNNE-UHFFFAOYSA-N
XLogP3.93
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.36
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-(cyclohepten-1-yl)ethanamine;hydrochloride
CID 75421023
cyclododecen-1-ylmethanamine
CID 70571219
1-butylcyclononene
CID 56981158
1-(aminomethyl)-N-[2-(cyclohexen-1-yl)ethyl]cyclohexane-1-carboxamide
CID 115437246
1-pentylcyclododecene
CID 150654776
ethyl 3-(cyclohepten-1-yl)propanoate
CID 135031394
cyclododecen-1-ylmethanol
CID 70464862
1-(cyclohexen-1-yl)cyclohexan-1-amine
CID 56996461
1-hexylcycloheptene
CID 15587826
1-nonylcyclooctene
CID 151486862
1-[4-(cyclopenten-1-yl)butyl]cyclopentene
CID 10420053
4-(cyclohexen-1-yl)butanamide
CID 165359181

Frequently Asked Questions

What is the IUPAC name of 1-[2-(cyclohexen-1-yl)ethyl]cyclohexan-1-amine?
The IUPAC name of 1-[2-(cyclohexen-1-yl)ethyl]cyclohexan-1-amine (CID 13381213) is 1-[2-(cyclohexen-1-yl)ethyl]cyclohexan-1-amine.
What is the SMILES notation for 1-[2-(cyclohexen-1-yl)ethyl]cyclohexan-1-amine?
The canonical SMILES for 1-[2-(cyclohexen-1-yl)ethyl]cyclohexan-1-amine is NC1(CCC2=CCCCC2)CCCCC1.
What is the InChIKey of 1-[2-(cyclohexen-1-yl)ethyl]cyclohexan-1-amine?
The InChIKey is AASFNLQJVANNNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N/c15-14(10-5-2-6-11-14)12-9-13-7-3-1-4-8-13/h7H,1-6,8-12,15H2.
What are the key properties of 1-[2-(cyclohexen-1-yl)ethyl]cyclohexan-1-amine?
1-[2-(cyclohexen-1-yl)ethyl]cyclohexan-1-amine has a molecular weight of 207.36 g/mol, XLogP of 3.93, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(cyclohexen-1-yl)ethyl]cyclohexan-1-amine is sourced from PubChem (CID 13381213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).