2-ethylcyclohexan-1-imine

C8H15N — CID 143834647

IUPAC2-ethylcyclohexan-1-imine
SMILES[H]/N=C1\CCCCC1CC
InChIInChI=1S/C8H15N/c1-2-7-5-3-4-6-8(7)9/h7,9H,2-6H2,1H3/b9-8+
InChIKeyQNUDKDMKUNXKJX-CMDGGOBGSA-N
MW125.21 g/mol
LogP2.61
Rot. Bonds1

About 2-ethylcyclohexan-1-imine

2-ethylcyclohexan-1-imine (PubChem CID 143834647) has the molecular formula C8H15N and a molecular weight of 125.21 g/mol. Its IUPAC name is 2-ethylcyclohexan-1-imine.

Molecular Properties

Compound Name2-ethylcyclohexan-1-imine
PubChem CID143834647
Molecular FormulaC8H15N
Molecular Weight125.21 g/mol
Exact Mass125.12
IUPAC Name2-ethylcyclohexan-1-imine
SMILES[H]/N=C1\CCCCC1CC
InChIInChI=1S/C8H15N/c1-2-7-5-3-4-6-8(7)9/h7,9H,2-6H2,1H3/b9-8+
InChIKeyQNUDKDMKUNXKJX-CMDGGOBGSA-N
XLogP2.61
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.21
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

N-cyclohexylpropylideneimine
CID 278552
Cyclohexanimine, 2,6-dimethyl-
CID 114554
(2-Methylcyclohexylidene)azanium
CID 57108412
2-(Cyclohexylmethyl)cyclohexan-1-imine
CID 123974588
Cyclohexyl ketazine
CID 129811703
1-[(5S)-2-fluoro-3,5-dimethylcyclohexyl]propan-1-imine
CID 138652436
1-Cyclohexyl-2,2,2-trifluoroethanimine
CID 141176955
(Z)-1-cyclohexylethylidenehydrazine
CID 129321218
N-cyclohexyl-1-cyclopropylethylideneimine
CID 129879364
(E)-1-cyclohexylethylidenehydrazine
CID 133633329
1-Diazoethylcyclohexane
CID 154252964
1-Cyclohexylethanimine
CID 18727539

Frequently Asked Questions

What is the IUPAC name of 2-ethylcyclohexan-1-imine?
The IUPAC name of 2-ethylcyclohexan-1-imine (CID 143834647) is 2-ethylcyclohexan-1-imine.
What is the SMILES notation for 2-ethylcyclohexan-1-imine?
The canonical SMILES for 2-ethylcyclohexan-1-imine is [H]/N=C1\CCCCC1CC.
What is the InChIKey of 2-ethylcyclohexan-1-imine?
The InChIKey is QNUDKDMKUNXKJX-CMDGGOBGSA-N. The full InChI is InChI=1S/C8H15N/c1-2-7-5-3-4-6-8(7)9/h7,9H,2-6H2,1H3/b9-8+.
What are the key properties of 2-ethylcyclohexan-1-imine?
2-ethylcyclohexan-1-imine has a molecular weight of 125.21 g/mol, XLogP of 2.61, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethylcyclohexan-1-imine is sourced from PubChem (CID 143834647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).