1-(2-methylcyclohexen-1-yl)ethanimine

C9H15N — CID 142983848

IUPAC1-(2-methylcyclohexen-1-yl)ethanimine
SMILES[H]/N=C(\C)C1=C(C)CCCC1
InChIInChI=1S/C9H15N/c1-7-5-3-4-6-9(7)8(2)10/h10H,3-6H2,1-2H3/b10-8+
InChIKeyBWNJOSAAKMHHNW-CSKARUKUSA-N
MW137.23 g/mol
LogP2.92
Rot. Bonds1

About 1-(2-methylcyclohexen-1-yl)ethanimine

1-(2-methylcyclohexen-1-yl)ethanimine (PubChem CID 142983848) has the molecular formula C9H15N and a molecular weight of 137.23 g/mol. Its IUPAC name is 1-(2-methylcyclohexen-1-yl)ethanimine.

Molecular Properties

Compound Name1-(2-methylcyclohexen-1-yl)ethanimine
PubChem CID142983848
Molecular FormulaC9H15N
Molecular Weight137.23 g/mol
Exact Mass137.12
IUPAC Name1-(2-methylcyclohexen-1-yl)ethanimine
SMILES[H]/N=C(\C)C1=C(C)CCCC1
InChIInChI=1S/C9H15N/c1-7-5-3-4-6-9(7)8(2)10/h10H,3-6H2,1-2H3/b10-8+
InChIKeyBWNJOSAAKMHHNW-CSKARUKUSA-N
XLogP2.92
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.23
LogP ≤ 52.92
H-Bond Donors ≤ 51
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 1-(2-methylcyclohexen-1-yl)ethanimine?
The IUPAC name of 1-(2-methylcyclohexen-1-yl)ethanimine (CID 142983848) is 1-(2-methylcyclohexen-1-yl)ethanimine.
What is the SMILES notation for 1-(2-methylcyclohexen-1-yl)ethanimine?
The canonical SMILES for 1-(2-methylcyclohexen-1-yl)ethanimine is [H]/N=C(\C)C1=C(C)CCCC1.
What is the InChIKey of 1-(2-methylcyclohexen-1-yl)ethanimine?
The InChIKey is BWNJOSAAKMHHNW-CSKARUKUSA-N. The full InChI is InChI=1S/C9H15N/c1-7-5-3-4-6-9(7)8(2)10/h10H,3-6H2,1-2H3/b10-8+.
What are the key properties of 1-(2-methylcyclohexen-1-yl)ethanimine?
1-(2-methylcyclohexen-1-yl)ethanimine has a molecular weight of 137.23 g/mol, XLogP of 2.92, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylcyclohexen-1-yl)ethanimine is sourced from PubChem (CID 142983848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).