(2-hept-6-enylcyclohexyl)methanamine

C14H27N — CID 107010667

IUPAC(2-hept-6-enylcyclohexyl)methanamine
SMILESC=CCCCCCC1CCCCC1CN
InChIInChI=1S/C14H27N/c1-2-3-4-5-6-9-13-10-7-8-11-14(13)12-15/h2,13-14H,1,3-12,15H2
InChIKeyYVPVSVIOIQPJQW-UHFFFAOYSA-N
MW209.38 g/mol
LogP3.89
Rot. Bonds7

About (2-hept-6-enylcyclohexyl)methanamine

(2-hept-6-enylcyclohexyl)methanamine (PubChem CID 107010667) has the molecular formula C14H27N and a molecular weight of 209.38 g/mol. Its IUPAC name is (2-hept-6-enylcyclohexyl)methanamine.

Molecular Properties

Compound Name(2-hept-6-enylcyclohexyl)methanamine
PubChem CID107010667
Molecular FormulaC14H27N
Molecular Weight209.38 g/mol
Exact Mass209.21
IUPAC Name(2-hept-6-enylcyclohexyl)methanamine
SMILESC=CCCCCCC1CCCCC1CN
InChIInChI=1S/C14H27N/c1-2-3-4-5-6-9-13-10-7-8-11-14(13)12-15/h2,13-14H,1,3-12,15H2
InChIKeyYVPVSVIOIQPJQW-UHFFFAOYSA-N
XLogP3.89
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.38
LogP ≤ 53.89
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

(2-pent-4-enylcyclohexyl)methanamine
CID 81010677
[2-(hept-6-enoxymethyl)cyclohexyl]methanamine
CID 107007728
2-hept-6-enylcyclohexane-1-carboxylic acid
CID 107010655
2-hept-6-enylcycloheptane-1-carboxylic acid
CID 107010657
hex-5-enylcyclopentane
CID 20565123
2-pent-4-enylcyclohexan-1-ol
CID 59087603
5-undec-10-enyl-2,11,20,29,37,38,39,40-octazanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetracontane
CID 173214279
1-hept-6-enyl-2-methylcyclopropane
CID 173435443
5,8,14,17,23,26,32,35-octakis(oct-7-enyl)-2,11,20,29,37,38,39,40-octazanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetracontane
CID 91154781
2-non-8-enyloxirane
CID 86075301
2-oct-7-enyloxirane
CID 160591597
1-ethenyl-2-octylcyclobutane;tetradec-1-ene
CID 173458281

Frequently Asked Questions

What is the IUPAC name of (2-hept-6-enylcyclohexyl)methanamine?
The IUPAC name of (2-hept-6-enylcyclohexyl)methanamine (CID 107010667) is (2-hept-6-enylcyclohexyl)methanamine.
What is the SMILES notation for (2-hept-6-enylcyclohexyl)methanamine?
The canonical SMILES for (2-hept-6-enylcyclohexyl)methanamine is C=CCCCCCC1CCCCC1CN.
What is the InChIKey of (2-hept-6-enylcyclohexyl)methanamine?
The InChIKey is YVPVSVIOIQPJQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N/c1-2-3-4-5-6-9-13-10-7-8-11-14(13)12-15/h2,13-14H,1,3-12,15H2.
What are the key properties of (2-hept-6-enylcyclohexyl)methanamine?
(2-hept-6-enylcyclohexyl)methanamine has a molecular weight of 209.38 g/mol, XLogP of 3.89, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-hept-6-enylcyclohexyl)methanamine is sourced from PubChem (CID 107010667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).