[(4R)-4-ethylcyclohexen-1-yl]methanimine

C9H15N — CID 145337918

IUPAC[(4R)-4-ethylcyclohexen-1-yl]methanimine
SMILES[H]/N=C/C1=CC[C@H](CC)CC1
InChIInChI=1S/C9H15N/c1-2-8-3-5-9(7-10)6-4-8/h5,7-8,10H,2-4,6H2,1H3/b10-7+/t8-/m0/s1
InChIKeyWULWMXILRDDVHO-VKHJRQFRSA-N
MW137.23 g/mol
LogP2.77
Rot. Bonds2

About [(4R)-4-ethylcyclohexen-1-yl]methanimine

[(4R)-4-ethylcyclohexen-1-yl]methanimine (PubChem CID 145337918) has the molecular formula C9H15N and a molecular weight of 137.23 g/mol. Its IUPAC name is [(4R)-4-ethylcyclohexen-1-yl]methanimine.

Molecular Properties

Compound Name[(4R)-4-ethylcyclohexen-1-yl]methanimine
PubChem CID145337918
Molecular FormulaC9H15N
Molecular Weight137.23 g/mol
Exact Mass137.12
IUPAC Name[(4R)-4-ethylcyclohexen-1-yl]methanimine
SMILES[H]/N=C/C1=CC[C@H](CC)CC1
InChIInChI=1S/C9H15N/c1-2-8-3-5-9(7-10)6-4-8/h5,7-8,10H,2-4,6H2,1H3/b10-7+/t8-/m0/s1
InChIKeyWULWMXILRDDVHO-VKHJRQFRSA-N
XLogP2.77
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.23
LogP ≤ 52.77
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 [(4R)-4-ethylcyclohexen-1-yl]methanimine?
The IUPAC name of [(4R)-4-ethylcyclohexen-1-yl]methanimine (CID 145337918) is [(4R)-4-ethylcyclohexen-1-yl]methanimine.
What is the SMILES notation for [(4R)-4-ethylcyclohexen-1-yl]methanimine?
The canonical SMILES for [(4R)-4-ethylcyclohexen-1-yl]methanimine is [H]/N=C/C1=CC[C@H](CC)CC1.
What is the InChIKey of [(4R)-4-ethylcyclohexen-1-yl]methanimine?
The InChIKey is WULWMXILRDDVHO-VKHJRQFRSA-N. The full InChI is InChI=1S/C9H15N/c1-2-8-3-5-9(7-10)6-4-8/h5,7-8,10H,2-4,6H2,1H3/b10-7+/t8-/m0/s1.
What are the key properties of [(4R)-4-ethylcyclohexen-1-yl]methanimine?
[(4R)-4-ethylcyclohexen-1-yl]methanimine has a molecular weight of 137.23 g/mol, XLogP of 2.77, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(4R)-4-ethylcyclohexen-1-yl]methanimine is sourced from PubChem (CID 145337918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).