N,1-dicyclohexylmethanimine

C13H23N — CID 11435477

IUPACN,1-dicyclohexylmethanimine
SMILESC(=N/C1CCCCC1)\C1CCCCC1
InChIInChI=1S/C13H23N/c1-3-7-12(8-4-1)11-14-13-9-5-2-6-10-13/h11-13H,1-10H2/b14-11+
InChIKeyJJKFACXTVSOZFK-SDNWHVSQSA-N
MW193.33 g/mol
LogP3.97
Rot. Bonds2

About N,1-dicyclohexylmethanimine

N,1-dicyclohexylmethanimine (PubChem CID 11435477) has the molecular formula C13H23N and a molecular weight of 193.33 g/mol. Its IUPAC name is N,1-dicyclohexylmethanimine.

Molecular Properties

Compound NameN,1-dicyclohexylmethanimine
PubChem CID11435477
Molecular FormulaC13H23N
Molecular Weight193.33 g/mol
Exact Mass193.18
IUPAC NameN,1-dicyclohexylmethanimine
SMILESC(=N/C1CCCCC1)\C1CCCCC1
InChIInChI=1S/C13H23N/c1-3-7-12(8-4-1)11-14-13-9-5-2-6-10-13/h11-13H,1-10H2/b14-11+
InChIKeyJJKFACXTVSOZFK-SDNWHVSQSA-N
XLogP3.97
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.33
LogP ≤ 53.97
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-dicyclohexylmethanimine?
The IUPAC name of N,1-dicyclohexylmethanimine (CID 11435477) is N,1-dicyclohexylmethanimine.
What is the SMILES notation for N,1-dicyclohexylmethanimine?
The canonical SMILES for N,1-dicyclohexylmethanimine is C(=N/C1CCCCC1)\C1CCCCC1.
What is the InChIKey of N,1-dicyclohexylmethanimine?
The InChIKey is JJKFACXTVSOZFK-SDNWHVSQSA-N. The full InChI is InChI=1S/C13H23N/c1-3-7-12(8-4-1)11-14-13-9-5-2-6-10-13/h11-13H,1-10H2/b14-11+.
What are the key properties of N,1-dicyclohexylmethanimine?
N,1-dicyclohexylmethanimine has a molecular weight of 193.33 g/mol, XLogP of 3.97, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dicyclohexylmethanimine is sourced from PubChem (CID 11435477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).