N-[(E)-3-cyclohexyl-2-methylprop-1-enyl]methanimine

C11H19N — CID 118055411

IUPACN-[(E)-3-cyclohexyl-2-methylprop-1-enyl]methanimine
SMILESC=N/C=C(\C)CC1CCCCC1
InChIInChI=1S/C11H19N/c1-10(9-12-2)8-11-6-4-3-5-7-11/h9,11H,2-8H2,1H3/b10-9+
InChIKeyVVZXMNKLWOJDPB-MDZDMXLPSA-N
MW165.28 g/mol
LogP3.56
Rot. Bonds3

About N-[(E)-3-cyclohexyl-2-methylprop-1-enyl]methanimine

N-[(E)-3-cyclohexyl-2-methylprop-1-enyl]methanimine (PubChem CID 118055411) has the molecular formula C11H19N and a molecular weight of 165.28 g/mol. Its IUPAC name is N-[(E)-3-cyclohexyl-2-methylprop-1-enyl]methanimine.

Molecular Properties

Compound NameN-[(E)-3-cyclohexyl-2-methylprop-1-enyl]methanimine
PubChem CID118055411
Molecular FormulaC11H19N
Molecular Weight165.28 g/mol
Exact Mass165.15
IUPAC NameN-[(E)-3-cyclohexyl-2-methylprop-1-enyl]methanimine
SMILESC=N/C=C(\C)CC1CCCCC1
InChIInChI=1S/C11H19N/c1-10(9-12-2)8-11-6-4-3-5-7-11/h9,11H,2-8H2,1H3/b10-9+
InChIKeyVVZXMNKLWOJDPB-MDZDMXLPSA-N
XLogP3.56
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.28
LogP ≤ 53.56
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-[(E)-3-cyclohexyl-2-methylprop-1-enyl]methanimine?
The IUPAC name of N-[(E)-3-cyclohexyl-2-methylprop-1-enyl]methanimine (CID 118055411) is N-[(E)-3-cyclohexyl-2-methylprop-1-enyl]methanimine.
What is the SMILES notation for N-[(E)-3-cyclohexyl-2-methylprop-1-enyl]methanimine?
The canonical SMILES for N-[(E)-3-cyclohexyl-2-methylprop-1-enyl]methanimine is C=N/C=C(\C)CC1CCCCC1.
What is the InChIKey of N-[(E)-3-cyclohexyl-2-methylprop-1-enyl]methanimine?
The InChIKey is VVZXMNKLWOJDPB-MDZDMXLPSA-N. The full InChI is InChI=1S/C11H19N/c1-10(9-12-2)8-11-6-4-3-5-7-11/h9,11H,2-8H2,1H3/b10-9+.
What are the key properties of N-[(E)-3-cyclohexyl-2-methylprop-1-enyl]methanimine?
N-[(E)-3-cyclohexyl-2-methylprop-1-enyl]methanimine has a molecular weight of 165.28 g/mol, XLogP of 3.56, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-3-cyclohexyl-2-methylprop-1-enyl]methanimine is sourced from PubChem (CID 118055411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).