cyclohex-2-en-1-yl(cyclohexyl)methanamine

C13H23N — CID 130054037

IUPACcyclohex-2-en-1-yl(cyclohexyl)methanamine
SMILESNC(C1C=CCCC1)C1CCCCC1
InChIInChI=1S/C13H23N/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h3,7,11-13H,1-2,4-6,8-10,14H2
InChIKeyNMNXGVRSRXIRAQ-UHFFFAOYSA-N
MW193.33 g/mol
LogP3.25
Rot. Bonds2

About cyclohex-2-en-1-yl(cyclohexyl)methanamine

cyclohex-2-en-1-yl(cyclohexyl)methanamine (PubChem CID 130054037) has the molecular formula C13H23N and a molecular weight of 193.33 g/mol. Its IUPAC name is cyclohex-2-en-1-yl(cyclohexyl)methanamine.

Molecular Properties

Compound Namecyclohex-2-en-1-yl(cyclohexyl)methanamine
PubChem CID130054037
Molecular FormulaC13H23N
Molecular Weight193.33 g/mol
Exact Mass193.18
IUPAC Namecyclohex-2-en-1-yl(cyclohexyl)methanamine
SMILESNC(C1C=CCCC1)C1CCCCC1
InChIInChI=1S/C13H23N/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h3,7,11-13H,1-2,4-6,8-10,14H2
InChIKeyNMNXGVRSRXIRAQ-UHFFFAOYSA-N
XLogP3.25
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.33
LogP ≤ 53.25
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-Cyclohex-3-enyl-1-methyl-ethylamine
CID 44272699
2-(Prop-2-en-1-yl)cyclohexan-1-amine
CID 12910255
Endo-bicyclo[3.3.1]nonan-6-ene-3-amine hydrochloride
CID 24194224
trans-(1R,2R)-2-prop-2-enylcyclohexan-1-amine
CID 12910256
2-Cyclohex-2-en-1-ylethanamine
CID 21432851
1-Cyclohexylpent-4-en-1-amine
CID 64298707
(1S)-1-cyclohexylpent-4-en-1-amine
CID 124488146
2-Naphthalenamine, 1,2,4a,5,6,7,8,8a-octahydro-4a-methyl-
CID 572962
Bicyclo[2.2.2]oct-5-en-2-amine
CID 13003781
4-Cyclooctene-1-methaneamine
CID 55288723
4-[2-(2,6-Difluorocyclohex-3-en-1-yl)ethyl]cyclohex-2-en-1-amine
CID 90382271
4-[2-(3,5-Difluorocyclohexen-1-yl)ethyl]cyclohexan-1-amine
CID 90382272

Frequently Asked Questions

What is the IUPAC name of cyclohex-2-en-1-yl(cyclohexyl)methanamine?
The IUPAC name of cyclohex-2-en-1-yl(cyclohexyl)methanamine (CID 130054037) is cyclohex-2-en-1-yl(cyclohexyl)methanamine.
What is the SMILES notation for cyclohex-2-en-1-yl(cyclohexyl)methanamine?
The canonical SMILES for cyclohex-2-en-1-yl(cyclohexyl)methanamine is NC(C1C=CCCC1)C1CCCCC1.
What is the InChIKey of cyclohex-2-en-1-yl(cyclohexyl)methanamine?
The InChIKey is NMNXGVRSRXIRAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h3,7,11-13H,1-2,4-6,8-10,14H2.
What are the key properties of cyclohex-2-en-1-yl(cyclohexyl)methanamine?
cyclohex-2-en-1-yl(cyclohexyl)methanamine has a molecular weight of 193.33 g/mol, XLogP of 3.25, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohex-2-en-1-yl(cyclohexyl)methanamine is sourced from PubChem (CID 130054037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).