N,1-dicyclohexylethanimine

C14H25N — CID 11095814

IUPACN,1-dicyclohexylethanimine
SMILESC/C(=N\C1CCCCC1)C1CCCCC1
InChIInChI=1S/C14H25N/c1-12(13-8-4-2-5-9-13)15-14-10-6-3-7-11-14/h13-14H,2-11H2,1H3/b15-12+
InChIKeyJLMSFOINTNSCGX-NTCAYCPXSA-N
MW207.36 g/mol
LogP4.36
Rot. Bonds2

About N,1-dicyclohexylethanimine

N,1-dicyclohexylethanimine (PubChem CID 11095814) has the molecular formula C14H25N and a molecular weight of 207.36 g/mol. Its IUPAC name is N,1-dicyclohexylethanimine.

Molecular Properties

Compound NameN,1-dicyclohexylethanimine
PubChem CID11095814
Molecular FormulaC14H25N
Molecular Weight207.36 g/mol
Exact Mass207.20
IUPAC NameN,1-dicyclohexylethanimine
SMILESC/C(=N\C1CCCCC1)C1CCCCC1
InChIInChI=1S/C14H25N/c1-12(13-8-4-2-5-9-13)15-14-10-6-3-7-11-14/h13-14H,2-11H2,1H3/b15-12+
InChIKeyJLMSFOINTNSCGX-NTCAYCPXSA-N
XLogP4.36
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.36
LogP ≤ 54.36
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,1-dicyclohexylethanimine?
The IUPAC name of N,1-dicyclohexylethanimine (CID 11095814) is N,1-dicyclohexylethanimine.
What is the SMILES notation for N,1-dicyclohexylethanimine?
The canonical SMILES for N,1-dicyclohexylethanimine is C/C(=N\C1CCCCC1)C1CCCCC1.
What is the InChIKey of N,1-dicyclohexylethanimine?
The InChIKey is JLMSFOINTNSCGX-NTCAYCPXSA-N. The full InChI is InChI=1S/C14H25N/c1-12(13-8-4-2-5-9-13)15-14-10-6-3-7-11-14/h13-14H,2-11H2,1H3/b15-12+.
What are the key properties of N,1-dicyclohexylethanimine?
N,1-dicyclohexylethanimine has a molecular weight of 207.36 g/mol, XLogP of 4.36, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dicyclohexylethanimine is sourced from PubChem (CID 11095814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).