1-(3-cyclohex-3-en-1-ylcyclohexyl)-N-methylmethanimine

C14H23N — CID 144834768

IUPAC1-(3-cyclohex-3-en-1-ylcyclohexyl)-N-methylmethanimine
SMILESC/N=C/C1CCCC(C2CC=CCC2)C1
InChIInChI=1S/C14H23N/c1-15-11-12-6-5-9-14(10-12)13-7-3-2-4-8-13/h2-3,11-14H,4-10H2,1H3/b15-11+
InChIKeyWDMIFBXIAZRNEN-RVDMUPIBSA-N
MW205.34 g/mol
LogP3.85
Rot. Bonds2

About 1-(3-cyclohex-3-en-1-ylcyclohexyl)-N-methylmethanimine

1-(3-cyclohex-3-en-1-ylcyclohexyl)-N-methylmethanimine (PubChem CID 144834768) has the molecular formula C14H23N and a molecular weight of 205.34 g/mol. Its IUPAC name is 1-(3-cyclohex-3-en-1-ylcyclohexyl)-N-methylmethanimine.

Molecular Properties

Compound Name1-(3-cyclohex-3-en-1-ylcyclohexyl)-N-methylmethanimine
PubChem CID144834768
Molecular FormulaC14H23N
Molecular Weight205.34 g/mol
Exact Mass205.18
IUPAC Name1-(3-cyclohex-3-en-1-ylcyclohexyl)-N-methylmethanimine
SMILESC/N=C/C1CCCC(C2CC=CCC2)C1
InChIInChI=1S/C14H23N/c1-15-11-12-6-5-9-14(10-12)13-7-3-2-4-8-13/h2-3,11-14H,4-10H2,1H3/b15-11+
InChIKeyWDMIFBXIAZRNEN-RVDMUPIBSA-N
XLogP3.85
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.34
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

3-cyclohex-3-en-1-ylcyclohexan-1-ol
CID 89084222
4-cyclopentylcyclohexene
CID 524571
4-(3-pentan-3-ylcyclohexyl)cyclohexene
CID 174503613
(1S,8S)-bicyclo[6.1.0]non-4-ene
CID 95564639
4,4a,5,6,7,8,9,9a-octahydro-1H-benzo[7]annulene
CID 123938044
(5E)-bicyclo[9.1.0]dodec-5-ene
CID 144561287
cyclooct-4-ene-1-carbaldehyde
CID 537409
4-(4-propylcyclohexyl)cyclohexene
CID 18964431
(2E,8E)-tricyclo[10.3.0.05,7]pentadeca-2,8-diene
CID 142484210
cyclododecene;cyclohexylcyclohexane
CID 173310836
N-cyclobutyl-N-methylcyclohex-3-en-1-amine
CID 145406243
1-[(E)-cyclohex-3-en-1-ylmethylideneamino]-3-methylthiourea
CID 110337362

Frequently Asked Questions

What is the IUPAC name of 1-(3-cyclohex-3-en-1-ylcyclohexyl)-N-methylmethanimine?
The IUPAC name of 1-(3-cyclohex-3-en-1-ylcyclohexyl)-N-methylmethanimine (CID 144834768) is 1-(3-cyclohex-3-en-1-ylcyclohexyl)-N-methylmethanimine.
What is the SMILES notation for 1-(3-cyclohex-3-en-1-ylcyclohexyl)-N-methylmethanimine?
The canonical SMILES for 1-(3-cyclohex-3-en-1-ylcyclohexyl)-N-methylmethanimine is C/N=C/C1CCCC(C2CC=CCC2)C1.
What is the InChIKey of 1-(3-cyclohex-3-en-1-ylcyclohexyl)-N-methylmethanimine?
The InChIKey is WDMIFBXIAZRNEN-RVDMUPIBSA-N. The full InChI is InChI=1S/C14H23N/c1-15-11-12-6-5-9-14(10-12)13-7-3-2-4-8-13/h2-3,11-14H,4-10H2,1H3/b15-11+.
What are the key properties of 1-(3-cyclohex-3-en-1-ylcyclohexyl)-N-methylmethanimine?
1-(3-cyclohex-3-en-1-ylcyclohexyl)-N-methylmethanimine has a molecular weight of 205.34 g/mol, XLogP of 3.85, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-cyclohex-3-en-1-ylcyclohexyl)-N-methylmethanimine is sourced from PubChem (CID 144834768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).