N-cyclohexyl-1-phenylethanimine

C14H19N — CID 10856535

IUPACN-cyclohexyl-1-phenylethanimine
SMILESC/C(=N\C1CCCCC1)c1ccccc1
InChIInChI=1S/C14H19N/c1-12(13-8-4-2-5-9-13)15-14-10-6-3-7-11-14/h2,4-5,8-9,14H,3,6-7,10-11H2,1H3/b15-12+
InChIKeyNVLVSZVGLGTPJM-NTCAYCPXSA-N
MW201.31 g/mol
LogP3.83
Rot. Bonds2

About N-cyclohexyl-1-phenylethanimine

N-cyclohexyl-1-phenylethanimine (PubChem CID 10856535) has the molecular formula C14H19N and a molecular weight of 201.31 g/mol. Its IUPAC name is N-cyclohexyl-1-phenylethanimine.

Molecular Properties

Compound NameN-cyclohexyl-1-phenylethanimine
PubChem CID10856535
Molecular FormulaC14H19N
Molecular Weight201.31 g/mol
Exact Mass201.15
IUPAC NameN-cyclohexyl-1-phenylethanimine
SMILESC/C(=N\C1CCCCC1)c1ccccc1
InChIInChI=1S/C14H19N/c1-12(13-8-4-2-5-9-13)15-14-10-6-3-7-11-14/h2,4-5,8-9,14H,3,6-7,10-11H2,1H3/b15-12+
InChIKeyNVLVSZVGLGTPJM-NTCAYCPXSA-N
XLogP3.83
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 53.83
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-cyclohexyl-1-phenylethanimine?
The IUPAC name of N-cyclohexyl-1-phenylethanimine (CID 10856535) is N-cyclohexyl-1-phenylethanimine.
What is the SMILES notation for N-cyclohexyl-1-phenylethanimine?
The canonical SMILES for N-cyclohexyl-1-phenylethanimine is C/C(=N\C1CCCCC1)c1ccccc1.
What is the InChIKey of N-cyclohexyl-1-phenylethanimine?
The InChIKey is NVLVSZVGLGTPJM-NTCAYCPXSA-N. The full InChI is InChI=1S/C14H19N/c1-12(13-8-4-2-5-9-13)15-14-10-6-3-7-11-14/h2,4-5,8-9,14H,3,6-7,10-11H2,1H3/b15-12+.
What are the key properties of N-cyclohexyl-1-phenylethanimine?
N-cyclohexyl-1-phenylethanimine has a molecular weight of 201.31 g/mol, XLogP of 3.83, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-1-phenylethanimine is sourced from PubChem (CID 10856535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).