N-tert-butyl-1-(3-tert-butylphenyl)methanimine

C15H23N — CID 22968786

IUPACN-tert-butyl-1-(3-tert-butylphenyl)methanimine
SMILESCC(C)(C)/N=C/c1cccc(C(C)(C)C)c1
InChIInChI=1S/C15H23N/c1-14(2,3)13-9-7-8-12(10-13)11-16-15(4,5)6/h7-11H,1-6H3/b16-11+
InChIKeyQTFHXANUEADDRA-LFIBNONCSA-N
MW217.36 g/mol
LogP4.20
Rot. Bonds1

About N-tert-butyl-1-(3-tert-butylphenyl)methanimine

N-tert-butyl-1-(3-tert-butylphenyl)methanimine (PubChem CID 22968786) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is N-tert-butyl-1-(3-tert-butylphenyl)methanimine.

Molecular Properties

Compound NameN-tert-butyl-1-(3-tert-butylphenyl)methanimine
PubChem CID22968786
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC NameN-tert-butyl-1-(3-tert-butylphenyl)methanimine
SMILESCC(C)(C)/N=C/c1cccc(C(C)(C)C)c1
InChIInChI=1S/C15H23N/c1-14(2,3)13-9-7-8-12(10-13)11-16-15(4,5)6/h7-11H,1-6H3/b16-11+
InChIKeyQTFHXANUEADDRA-LFIBNONCSA-N
XLogP4.20
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 54.20
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

1-tert-butyl-3-[(E)-2-(4-tert-butylphenyl)ethenyl]benzene
CID 164762812
N-tert-butyl-1-(3-diphenylphosphanyloxyphenyl)methanimine
CID 122216192
alumane;1,3-ditert-butylbenzene
CID 174392215
magnesium;1,3-ditert-butylbenzene;dibromide
CID 174717429
N-tert-butylsulfanyl-1-[3-(trifluoromethyl)phenyl]methanimine
CID 174813041
1-(benzylideneamino)-1-phenylethanol
CID 154107002
1-(4-bromobut-1-enyl)-3-tert-butylbenzene
CID 170497666
bis(3-tert-butylphenyl)methanediamine
CID 141292033
1-tert-butyl-3-(3-tert-butylphenyl)benzene;ethane
CID 159548907
4-(3-tert-butylphenyl)but-3-enamide
CID 170798133
3-(benzylideneamino)-3-methylbutan-2-ol
CID 130129023
N-(3-tert-butylphenyl)-2,2-dimethylpropan-1-imine
CID 177288460

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-1-(3-tert-butylphenyl)methanimine?
The IUPAC name of N-tert-butyl-1-(3-tert-butylphenyl)methanimine (CID 22968786) is N-tert-butyl-1-(3-tert-butylphenyl)methanimine.
What is the SMILES notation for N-tert-butyl-1-(3-tert-butylphenyl)methanimine?
The canonical SMILES for N-tert-butyl-1-(3-tert-butylphenyl)methanimine is CC(C)(C)/N=C/c1cccc(C(C)(C)C)c1.
What is the InChIKey of N-tert-butyl-1-(3-tert-butylphenyl)methanimine?
The InChIKey is QTFHXANUEADDRA-LFIBNONCSA-N. The full InChI is InChI=1S/C15H23N/c1-14(2,3)13-9-7-8-12(10-13)11-16-15(4,5)6/h7-11H,1-6H3/b16-11+.
What are the key properties of N-tert-butyl-1-(3-tert-butylphenyl)methanimine?
N-tert-butyl-1-(3-tert-butylphenyl)methanimine has a molecular weight of 217.36 g/mol, XLogP of 4.20, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-1-(3-tert-butylphenyl)methanimine is sourced from PubChem (CID 22968786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).