N-phenyl-1-(2,4,6-trimethylphenyl)methanimine

C16H17N — CID 641176

IUPACN-phenyl-1-(2,4,6-trimethylphenyl)methanimine
SMILESCc1cc(C)c(/C=N/c2ccccc2)c(C)c1
InChIInChI=1S/C16H17N/c1-12-9-13(2)16(14(3)10-12)11-17-15-7-5-4-6-8-15/h4-11H,1-3H3/b17-11+
InChIKeyOEUKMWQCHJILLN-GZTJUZNOSA-N
MW223.32 g/mol
LogP4.36
Rot. Bonds2

About N-phenyl-1-(2,4,6-trimethylphenyl)methanimine

N-phenyl-1-(2,4,6-trimethylphenyl)methanimine (PubChem CID 641176) has the molecular formula C16H17N and a molecular weight of 223.32 g/mol. Its IUPAC name is N-phenyl-1-(2,4,6-trimethylphenyl)methanimine.

Molecular Properties

Compound NameN-phenyl-1-(2,4,6-trimethylphenyl)methanimine
PubChem CID641176
Molecular FormulaC16H17N
Molecular Weight223.32 g/mol
Exact Mass223.14
IUPAC NameN-phenyl-1-(2,4,6-trimethylphenyl)methanimine
SMILESCc1cc(C)c(/C=N/c2ccccc2)c(C)c1
InChIInChI=1S/C16H17N/c1-12-9-13(2)16(14(3)10-12)11-17-15-7-5-4-6-8-15/h4-11H,1-3H3/b17-11+
InChIKeyOEUKMWQCHJILLN-GZTJUZNOSA-N
XLogP4.36
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
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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Related Compounds

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CID 10858
N-benzylidene-4-methylaniline
CID 75276
N-(3-Phenyl-2-propenylidene)aniline
CID 291034
N-(4-Methylbenzylidene)-P-toluidine
CID 525721
Morphanthridine
CID 10878016
N,N'-Terephthalylidenebis(4-butylaniline)
CID 141503
N-Cinnamylideneaniline
CID 5375816
N-(4-Methylbenzylidene)aniline
CID 525732
(E)-N-(4-(Trifluoromethyl)benzylidene)aniline
CID 11747016
N-(9-Anthracenylmethylene)-P-toluidine
CID 4231994
N,N'-Terephthalylidenedianiline
CID 291023
N-Benzylidene-4-biphenylamine
CID 292639

Frequently Asked Questions

What is the IUPAC name of N-phenyl-1-(2,4,6-trimethylphenyl)methanimine?
The IUPAC name of N-phenyl-1-(2,4,6-trimethylphenyl)methanimine (CID 641176) is N-phenyl-1-(2,4,6-trimethylphenyl)methanimine.
What is the SMILES notation for N-phenyl-1-(2,4,6-trimethylphenyl)methanimine?
The canonical SMILES for N-phenyl-1-(2,4,6-trimethylphenyl)methanimine is Cc1cc(C)c(/C=N/c2ccccc2)c(C)c1.
What is the InChIKey of N-phenyl-1-(2,4,6-trimethylphenyl)methanimine?
The InChIKey is OEUKMWQCHJILLN-GZTJUZNOSA-N. The full InChI is InChI=1S/C16H17N/c1-12-9-13(2)16(14(3)10-12)11-17-15-7-5-4-6-8-15/h4-11H,1-3H3/b17-11+.
What are the key properties of N-phenyl-1-(2,4,6-trimethylphenyl)methanimine?
N-phenyl-1-(2,4,6-trimethylphenyl)methanimine has a molecular weight of 223.32 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-phenyl-1-(2,4,6-trimethylphenyl)methanimine is sourced from PubChem (CID 641176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).