2-(4-methylcyclohexyl)prop-2-en-1-imine

C10H17N — CID 146609765

IUPAC2-(4-methylcyclohexyl)prop-2-en-1-imine
SMILES[H]/N=C/C(=C)C1CCC(C)CC1
InChIInChI=1S/C10H17N/c1-8-3-5-10(6-4-8)9(2)7-11/h7-8,10-11H,2-6H2,1H3/b11-7+
InChIKeyVWESLIBDORYSSE-YRNVUSSQSA-N
MW151.25 g/mol
LogP3.02
Rot. Bonds2

About 2-(4-methylcyclohexyl)prop-2-en-1-imine

2-(4-methylcyclohexyl)prop-2-en-1-imine (PubChem CID 146609765) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is 2-(4-methylcyclohexyl)prop-2-en-1-imine.

Molecular Properties

Compound Name2-(4-methylcyclohexyl)prop-2-en-1-imine
PubChem CID146609765
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name2-(4-methylcyclohexyl)prop-2-en-1-imine
SMILES[H]/N=C/C(=C)C1CCC(C)CC1
InChIInChI=1S/C10H17N/c1-8-3-5-10(6-4-8)9(2)7-11/h7-8,10-11H,2-6H2,1H3/b11-7+
InChIKeyVWESLIBDORYSSE-YRNVUSSQSA-N
XLogP3.02
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 53.02
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 2-(4-methylcyclohexyl)prop-2-en-1-imine?
The IUPAC name of 2-(4-methylcyclohexyl)prop-2-en-1-imine (CID 146609765) is 2-(4-methylcyclohexyl)prop-2-en-1-imine.
What is the SMILES notation for 2-(4-methylcyclohexyl)prop-2-en-1-imine?
The canonical SMILES for 2-(4-methylcyclohexyl)prop-2-en-1-imine is [H]/N=C/C(=C)C1CCC(C)CC1.
What is the InChIKey of 2-(4-methylcyclohexyl)prop-2-en-1-imine?
The InChIKey is VWESLIBDORYSSE-YRNVUSSQSA-N. The full InChI is InChI=1S/C10H17N/c1-8-3-5-10(6-4-8)9(2)7-11/h7-8,10-11H,2-6H2,1H3/b11-7+.
What are the key properties of 2-(4-methylcyclohexyl)prop-2-en-1-imine?
2-(4-methylcyclohexyl)prop-2-en-1-imine has a molecular weight of 151.25 g/mol, XLogP of 3.02, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylcyclohexyl)prop-2-en-1-imine is sourced from PubChem (CID 146609765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).