N-cyclohexyl-3-methylcyclohexan-1-imine

C13H23N — CID 13272648

IUPACN-cyclohexyl-3-methylcyclohexan-1-imine
SMILESCC1CCC/C(=N\C2CCCCC2)C1
InChIInChI=1S/C13H23N/c1-11-6-5-9-13(10-11)14-12-7-3-2-4-8-12/h11-12H,2-10H2,1H3/b14-13+
InChIKeySWSKNDAEMATQDC-BUHFOSPRSA-N
MW193.33 g/mol
LogP3.97
Rot. Bonds1

About N-cyclohexyl-3-methylcyclohexan-1-imine

N-cyclohexyl-3-methylcyclohexan-1-imine (PubChem CID 13272648) has the molecular formula C13H23N and a molecular weight of 193.33 g/mol. Its IUPAC name is N-cyclohexyl-3-methylcyclohexan-1-imine.

Molecular Properties

Compound NameN-cyclohexyl-3-methylcyclohexan-1-imine
PubChem CID13272648
Molecular FormulaC13H23N
Molecular Weight193.33 g/mol
Exact Mass193.18
IUPAC NameN-cyclohexyl-3-methylcyclohexan-1-imine
SMILESCC1CCC/C(=N\C2CCCCC2)C1
InChIInChI=1S/C13H23N/c1-11-6-5-9-13(10-11)14-12-7-3-2-4-8-12/h11-12H,2-10H2,1H3/b14-13+
InChIKeySWSKNDAEMATQDC-BUHFOSPRSA-N
XLogP3.97
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.33
LogP ≤ 53.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-3-methylcyclohexan-1-imine?
The IUPAC name of N-cyclohexyl-3-methylcyclohexan-1-imine (CID 13272648) is N-cyclohexyl-3-methylcyclohexan-1-imine.
What is the SMILES notation for N-cyclohexyl-3-methylcyclohexan-1-imine?
The canonical SMILES for N-cyclohexyl-3-methylcyclohexan-1-imine is CC1CCC/C(=N\C2CCCCC2)C1.
What is the InChIKey of N-cyclohexyl-3-methylcyclohexan-1-imine?
The InChIKey is SWSKNDAEMATQDC-BUHFOSPRSA-N. The full InChI is InChI=1S/C13H23N/c1-11-6-5-9-13(10-11)14-12-7-3-2-4-8-12/h11-12H,2-10H2,1H3/b14-13+.
What are the key properties of N-cyclohexyl-3-methylcyclohexan-1-imine?
N-cyclohexyl-3-methylcyclohexan-1-imine has a molecular weight of 193.33 g/mol, XLogP of 3.97, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-3-methylcyclohexan-1-imine is sourced from PubChem (CID 13272648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).