N-(2-ethenyl-5-methylcyclohexen-1-yl)methanimine

C10H15N — CID 153389496

IUPACN-(2-ethenyl-5-methylcyclohexen-1-yl)methanimine
SMILESC=CC1=C(N=C)CC(C)CC1
InChIInChI=1S/C10H15N/c1-4-9-6-5-8(2)7-10(9)11-3/h4,8H,1,3,5-7H2,2H3
InChIKeyOMRRBFJNTRKFMB-UHFFFAOYSA-N
MW149.24 g/mol
LogP2.95
Rot. Bonds2

About N-(2-ethenyl-5-methylcyclohexen-1-yl)methanimine

N-(2-ethenyl-5-methylcyclohexen-1-yl)methanimine (PubChem CID 153389496) has the molecular formula C10H15N and a molecular weight of 149.24 g/mol. Its IUPAC name is N-(2-ethenyl-5-methylcyclohexen-1-yl)methanimine.

Molecular Properties

Compound NameN-(2-ethenyl-5-methylcyclohexen-1-yl)methanimine
PubChem CID153389496
Molecular FormulaC10H15N
Molecular Weight149.24 g/mol
Exact Mass149.12
IUPAC NameN-(2-ethenyl-5-methylcyclohexen-1-yl)methanimine
SMILESC=CC1=C(N=C)CC(C)CC1
InChIInChI=1S/C10H15N/c1-4-9-6-5-8(2)7-10(9)11-3/h4,8H,1,3,5-7H2,2H3
InChIKeyOMRRBFJNTRKFMB-UHFFFAOYSA-N
XLogP2.95
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.24
LogP ≤ 52.95
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-(2-ethenyl-5-methylcyclohexen-1-yl)methanimine?
The IUPAC name of N-(2-ethenyl-5-methylcyclohexen-1-yl)methanimine (CID 153389496) is N-(2-ethenyl-5-methylcyclohexen-1-yl)methanimine.
What is the SMILES notation for N-(2-ethenyl-5-methylcyclohexen-1-yl)methanimine?
The canonical SMILES for N-(2-ethenyl-5-methylcyclohexen-1-yl)methanimine is C=CC1=C(N=C)CC(C)CC1.
What is the InChIKey of N-(2-ethenyl-5-methylcyclohexen-1-yl)methanimine?
The InChIKey is OMRRBFJNTRKFMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N/c1-4-9-6-5-8(2)7-10(9)11-3/h4,8H,1,3,5-7H2,2H3.
What are the key properties of N-(2-ethenyl-5-methylcyclohexen-1-yl)methanimine?
N-(2-ethenyl-5-methylcyclohexen-1-yl)methanimine has a molecular weight of 149.24 g/mol, XLogP of 2.95, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethenyl-5-methylcyclohexen-1-yl)methanimine is sourced from PubChem (CID 153389496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).