N-(cyclohex-3-en-1-ylmethyl)-1-cyclohexylmethanamine

C14H25N — CID 43215811

IUPACN-(cyclohex-3-en-1-ylmethyl)-1-cyclohexylmethanamine
SMILESC1=CCC(CNCC2CCCCC2)CC1
InChIInChI=1S/C14H25N/c1-3-7-13(8-4-1)11-15-12-14-9-5-2-6-10-14/h1,3,13-15H,2,4-12H2
InChIKeyHOBFUKCOHAANKB-UHFFFAOYSA-N
MW207.36 g/mol
LogP3.51
Rot. Bonds4

About N-(cyclohex-3-en-1-ylmethyl)-1-cyclohexylmethanamine

N-(cyclohex-3-en-1-ylmethyl)-1-cyclohexylmethanamine (PubChem CID 43215811) has the molecular formula C14H25N and a molecular weight of 207.36 g/mol. Its IUPAC name is N-(cyclohex-3-en-1-ylmethyl)-1-cyclohexylmethanamine.

Molecular Properties

Compound NameN-(cyclohex-3-en-1-ylmethyl)-1-cyclohexylmethanamine
PubChem CID43215811
Molecular FormulaC14H25N
Molecular Weight207.36 g/mol
Exact Mass207.20
IUPAC NameN-(cyclohex-3-en-1-ylmethyl)-1-cyclohexylmethanamine
SMILESC1=CCC(CNCC2CCCCC2)CC1
InChIInChI=1S/C14H25N/c1-3-7-13(8-4-1)11-15-12-14-9-5-2-6-10-14/h1,3,13-15H,2,4-12H2
InChIKeyHOBFUKCOHAANKB-UHFFFAOYSA-N
XLogP3.51
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.36
LogP ≤ 53.51
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

N-(cyclohex-3-en-1-ylmethyl)cyclododecanamine
CID 63478638
N-(cyclohex-3-en-1-ylmethyl)-3-cyclohexyloxypropan-1-amine
CID 43081150
trans-(1R,2R)-2-(cyclohex-3-en-1-ylmethylamino)cyclohexan-1-ol
CID 104923298
cis-(1R,2S)-2-[[(1S)-cyclohex-3-en-1-yl]methylamino]cyclohexan-1-ol
CID 124673828
2-(cyclohex-3-en-1-ylmethylamino)ethyl carbamate
CID 83211813
6-(cyclohex-3-en-1-ylmethylamino)hexan-1-ol
CID 115908967
1-cyclobutyl-N-(cyclobutylmethyl)methanamine
CID 54206114
N-(cyclohex-3-en-1-ylmethyl)-2-cyclopentylpropan-2-amine
CID 115868307
tert-butyl 2-[(cyclohex-3-en-1-ylmethylamino)methyl]piperidine-1-carboxylate
CID 106633840
methyl 2-cyclohex-3-en-1-ylacetate
CID 12739784
1-cyclohex-3-en-1-yl-N-[(5,5-dimethyloxolan-2-yl)methyl]methanamine
CID 116521376
cis-(1S,2R)-2-(cyclohex-3-en-1-ylmethylcarbamoyl)cyclohexane-1-carboxylic acid
CID 114092192

Frequently Asked Questions

What is the IUPAC name of N-(cyclohex-3-en-1-ylmethyl)-1-cyclohexylmethanamine?
The IUPAC name of N-(cyclohex-3-en-1-ylmethyl)-1-cyclohexylmethanamine (CID 43215811) is N-(cyclohex-3-en-1-ylmethyl)-1-cyclohexylmethanamine.
What is the SMILES notation for N-(cyclohex-3-en-1-ylmethyl)-1-cyclohexylmethanamine?
The canonical SMILES for N-(cyclohex-3-en-1-ylmethyl)-1-cyclohexylmethanamine is C1=CCC(CNCC2CCCCC2)CC1.
What is the InChIKey of N-(cyclohex-3-en-1-ylmethyl)-1-cyclohexylmethanamine?
The InChIKey is HOBFUKCOHAANKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N/c1-3-7-13(8-4-1)11-15-12-14-9-5-2-6-10-14/h1,3,13-15H,2,4-12H2.
What are the key properties of N-(cyclohex-3-en-1-ylmethyl)-1-cyclohexylmethanamine?
N-(cyclohex-3-en-1-ylmethyl)-1-cyclohexylmethanamine has a molecular weight of 207.36 g/mol, XLogP of 3.51, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohex-3-en-1-ylmethyl)-1-cyclohexylmethanamine is sourced from PubChem (CID 43215811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).