N-cyclohexylcyclododecanimine

C18H33N — CID 12713305

IUPACN-cyclohexylcyclododecanimine
SMILESC1CCCCCC(=NC2CCCCC2)CCCCC1
InChIInChI=1S/C18H33N/c1-2-4-6-9-13-17(14-10-7-5-3-1)19-18-15-11-8-12-16-18/h18H,1-16H2
InChIKeyLWYXBVLUIZEDRO-UHFFFAOYSA-N
MW263.47 g/mol
LogP6.06
Rot. Bonds1

About N-cyclohexylcyclododecanimine

N-cyclohexylcyclododecanimine (PubChem CID 12713305) has the molecular formula C18H33N and a molecular weight of 263.47 g/mol. Its IUPAC name is N-cyclohexylcyclododecanimine.

Molecular Properties

Compound NameN-cyclohexylcyclododecanimine
PubChem CID12713305
Molecular FormulaC18H33N
Molecular Weight263.47 g/mol
Exact Mass263.26
IUPAC NameN-cyclohexylcyclododecanimine
SMILESC1CCCCCC(=NC2CCCCC2)CCCCC1
InChIInChI=1S/C18H33N/c1-2-4-6-9-13-17(14-10-7-5-3-1)19-18-15-11-8-12-16-18/h18H,1-16H2
InChIKeyLWYXBVLUIZEDRO-UHFFFAOYSA-N
XLogP6.06
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500263.47
LogP ≤ 56.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-cyclopentylcyclopentanimine
CID 71356243
2-cyclohexyliminocyclohexan-1-one
CID 154158221
N-cycloheptyl-4-trimethylsilylsulfanylcyclohexan-1-imine
CID 140768345
N-cyclohexyl-2-trimethylsilylsulfanylcycloheptan-1-imine
CID 140768335
N-(cyclooctadecylideneamino)cyclooctadecanimine
CID 22178407
N-(7-methylcyclododecylidene)hydroxylamine
CID 145162262
N-cyclohexyltricyclo[8.2.2.24,7]hexadeca-1(13),4,6,10(14),11,15-hexaen-2-imine
CID 101141885
5-cyclopentylimino-3,3-dimethylcyclohexan-1-one
CID 91161890
N-cyclohexyl-2-phenylcyclobutan-1-imine
CID 102179459
N-cyclopentyl-2-trimethylsilylsulfanylcyclohexan-1-imine
CID 140768111
N-(cyclohexylideneamino)-2-methylcyclohexan-1-imine
CID 70615985
nitrosocyclopentadecane
CID 89341033

Frequently Asked Questions

What is the IUPAC name of N-cyclohexylcyclododecanimine?
The IUPAC name of N-cyclohexylcyclododecanimine (CID 12713305) is N-cyclohexylcyclododecanimine.
What is the SMILES notation for N-cyclohexylcyclododecanimine?
The canonical SMILES for N-cyclohexylcyclododecanimine is C1CCCCCC(=NC2CCCCC2)CCCCC1.
What is the InChIKey of N-cyclohexylcyclododecanimine?
The InChIKey is LWYXBVLUIZEDRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H33N/c1-2-4-6-9-13-17(14-10-7-5-3-1)19-18-15-11-8-12-16-18/h18H,1-16H2.
What are the key properties of N-cyclohexylcyclododecanimine?
N-cyclohexylcyclododecanimine has a molecular weight of 263.47 g/mol, XLogP of 6.06, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexylcyclododecanimine is sourced from PubChem (CID 12713305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).