N-cyclohexylethanimine

C8H15N — CID 10964544

IUPACN-cyclohexylethanimine
SMILESC/C=N/C1CCCCC1
InChIInChI=1S/C8H15N/c1-2-9-8-6-4-3-5-7-8/h2,8H,3-7H2,1H3/b9-2+
InChIKeyQWMYJOXBVBZDJM-XNWCZRBMSA-N
MW125.21 g/mol
LogP2.41
Rot. Bonds1

About N-cyclohexylethanimine

N-cyclohexylethanimine (PubChem CID 10964544) has the molecular formula C8H15N and a molecular weight of 125.21 g/mol. Its IUPAC name is N-cyclohexylethanimine.

Molecular Properties

Compound NameN-cyclohexylethanimine
PubChem CID10964544
Molecular FormulaC8H15N
Molecular Weight125.21 g/mol
Exact Mass125.12
IUPAC NameN-cyclohexylethanimine
SMILESC/C=N/C1CCCCC1
InChIInChI=1S/C8H15N/c1-2-9-8-6-4-3-5-7-8/h2,8H,3-7H2,1H3/b9-2+
InChIKeyQWMYJOXBVBZDJM-XNWCZRBMSA-N
XLogP2.41
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.21
LogP ≤ 52.41
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-cyclohexylethanimine?
The IUPAC name of N-cyclohexylethanimine (CID 10964544) is N-cyclohexylethanimine.
What is the SMILES notation for N-cyclohexylethanimine?
The canonical SMILES for N-cyclohexylethanimine is C/C=N/C1CCCCC1.
What is the InChIKey of N-cyclohexylethanimine?
The InChIKey is QWMYJOXBVBZDJM-XNWCZRBMSA-N. The full InChI is InChI=1S/C8H15N/c1-2-9-8-6-4-3-5-7-8/h2,8H,3-7H2,1H3/b9-2+.
What are the key properties of N-cyclohexylethanimine?
N-cyclohexylethanimine has a molecular weight of 125.21 g/mol, XLogP of 2.41, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexylethanimine is sourced from PubChem (CID 10964544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).