N-(2,6-diethylphenyl)ethanimine;ethane

C14H23N — CID 177158667

IUPACN-(2,6-diethylphenyl)ethanimine;ethane
SMILESC/C=N/c1c(CC)cccc1CC.CC
InChIInChI=1S/C12H17N.C2H6/c1-4-10-8-7-9-11(5-2)12(10)13-6-3;1-2/h6-9H,4-5H2,1-3H3;1-2H3/b13-6+;
InChIKeyODGLBCKFPUDCKO-AWFSDRIXSA-N
MW205.34 g/mol
LogP4.56
Rot. Bonds3

About N-(2,6-diethylphenyl)ethanimine;ethane

N-(2,6-diethylphenyl)ethanimine;ethane (PubChem CID 177158667) has the molecular formula C14H23N and a molecular weight of 205.34 g/mol. Its IUPAC name is N-(2,6-diethylphenyl)ethanimine;ethane.

Molecular Properties

Compound NameN-(2,6-diethylphenyl)ethanimine;ethane
PubChem CID177158667
Molecular FormulaC14H23N
Molecular Weight205.34 g/mol
Exact Mass205.18
IUPAC NameN-(2,6-diethylphenyl)ethanimine;ethane
SMILESC/C=N/c1c(CC)cccc1CC.CC
InChIInChI=1S/C12H17N.C2H6/c1-4-10-8-7-9-11(5-2)12(10)13-6-3;1-2/h6-9H,4-5H2,1-3H3;1-2H3/b13-6+;
InChIKeyODGLBCKFPUDCKO-AWFSDRIXSA-N
XLogP4.56
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.34
LogP ≤ 54.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-(2,6-diethylphenyl)-1-[6-[(2,6-diethylphenyl)iminomethyl]-2-pyridinyl]methanimine;iron(3+);trichloride
CID 70014772
butane;N-(2,6-dimethylphenyl)ethanimine;ethane;formaldehyde;1,4-xylene
CID 143995996
3-[(2,6-diethylphenyl)iminomethyl]benzene-1,2-diol
CID 136753923
N-(2,6-dimethylphenyl)ethanimine
CID 10993945
methyl N-(2-ethyl-6-methylphenyl)methanimidate
CID 15176777
1,3-diethyl-2-iodobenzene
CID 18690512
1-[4-chloro-6-[(2,6-diethylphenyl)iminomethyl]-2-pyridinyl]-N-(2,6-diethylphenyl)methanimine;cobalt(2+);dichloride
CID 70014357
trialuminum;carbanide;(2,6-diethylphenyl)-[(2,6-diethylphenyl)iminomethyl]azanide;lanthanum(3+);toluene
CID 139108362
N-(2,6-diethylphenyl)-1-pyrazin-2-ylmethanimine;nickel
CID 87860521
N-(2-ethyl-6-methylphenyl)-1-[5-[(2-ethyl-6-methylphenyl)iminomethyl]furan-2-yl]methanimine
CID 22968266
acetylene;butane;N-(2,6-dimethylphenyl)ethanimine;ethane;formaldehyde;1-methylnaphthalene
CID 143996006
N-(2-propylphenyl)ethanimine
CID 67389044

Frequently Asked Questions

What is the IUPAC name of N-(2,6-diethylphenyl)ethanimine;ethane?
The IUPAC name of N-(2,6-diethylphenyl)ethanimine;ethane (CID 177158667) is N-(2,6-diethylphenyl)ethanimine;ethane.
What is the SMILES notation for N-(2,6-diethylphenyl)ethanimine;ethane?
The canonical SMILES for N-(2,6-diethylphenyl)ethanimine;ethane is C/C=N/c1c(CC)cccc1CC.CC.
What is the InChIKey of N-(2,6-diethylphenyl)ethanimine;ethane?
The InChIKey is ODGLBCKFPUDCKO-AWFSDRIXSA-N. The full InChI is InChI=1S/C12H17N.C2H6/c1-4-10-8-7-9-11(5-2)12(10)13-6-3;1-2/h6-9H,4-5H2,1-3H3;1-2H3/b13-6+;.
What are the key properties of N-(2,6-diethylphenyl)ethanimine;ethane?
N-(2,6-diethylphenyl)ethanimine;ethane has a molecular weight of 205.34 g/mol, XLogP of 4.56, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-diethylphenyl)ethanimine;ethane is sourced from PubChem (CID 177158667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).