N-cyclohexylmethanimine;ethane

C9H19N — CID 91081056

IUPACN-cyclohexylmethanimine;ethane
SMILESC=NC1CCCCC1.CC
InChIInChI=1S/C7H13N.C2H6/c1-8-7-5-3-2-4-6-7;1-2/h7H,1-6H2;1-2H3
InChIKeyNXGOXCYNRITGPA-UHFFFAOYSA-N
MW141.26 g/mol
LogP3.05
Rot. Bonds1

About N-cyclohexylmethanimine;ethane

N-cyclohexylmethanimine;ethane (PubChem CID 91081056) has the molecular formula C9H19N and a molecular weight of 141.26 g/mol. Its IUPAC name is N-cyclohexylmethanimine;ethane.

Molecular Properties

Compound NameN-cyclohexylmethanimine;ethane
PubChem CID91081056
Molecular FormulaC9H19N
Molecular Weight141.26 g/mol
Exact Mass141.15
IUPAC NameN-cyclohexylmethanimine;ethane
SMILESC=NC1CCCCC1.CC
InChIInChI=1S/C7H13N.C2H6/c1-8-7-5-3-2-4-6-7;1-2/h7H,1-6H2;1-2H3
InChIKeyNXGOXCYNRITGPA-UHFFFAOYSA-N
XLogP3.05
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.26
LogP ≤ 53.05
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-cyclobutylmethanimine
CID 123570693
N-cyclohexylmethanimine;1,2-dicyclohexylhydrazine
CID 144690483
nitrosocycloheptane
CID 54252877
nitrosocyclopentadecane
CID 89341033
N-(cyclohexyldiazenyl)methanimine
CID 144808265
N-methyl-4-(methylideneamino)cyclohexan-1-amine
CID 139444737
N-piperidin-3-ylmethanimine
CID 58804640
N-cyclohexylethenimine
CID 22149410
thionitrosocyclohexane
CID 58392811
N-cyclohexyl-3-methylbut-3-en-2-imine
CID 86006546
ethane;methylcyclohexane;methylcyclopentane
CID 159395989
N-cyclohexylpropan-1-imine
CID 3489363

Frequently Asked Questions

What is the IUPAC name of N-cyclohexylmethanimine;ethane?
The IUPAC name of N-cyclohexylmethanimine;ethane (CID 91081056) is N-cyclohexylmethanimine;ethane.
What is the SMILES notation for N-cyclohexylmethanimine;ethane?
The canonical SMILES for N-cyclohexylmethanimine;ethane is C=NC1CCCCC1.CC.
What is the InChIKey of N-cyclohexylmethanimine;ethane?
The InChIKey is NXGOXCYNRITGPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N.C2H6/c1-8-7-5-3-2-4-6-7;1-2/h7H,1-6H2;1-2H3.
What are the key properties of N-cyclohexylmethanimine;ethane?
N-cyclohexylmethanimine;ethane has a molecular weight of 141.26 g/mol, XLogP of 3.05, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexylmethanimine;ethane is sourced from PubChem (CID 91081056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).