2,2-dimethyl-N-(2,4,6-trimethylphenyl)-1,3-dihydroquinolin-4-imine

C20H24N2 — CID 139257919

IUPAC2,2-dimethyl-N-(2,4,6-trimethylphenyl)-1,3-dihydroquinolin-4-imine
SMILESCc1cc(C)c(/N=C2\CC(C)(C)Nc3ccccc32)c(C)c1
InChIInChI=1S/C20H24N2/c1-13-10-14(2)19(15(3)11-13)21-18-12-20(4,5)22-17-9-7-6-8-16(17)18/h6-11,22H,12H2,1-5H3/b21-18+
InChIKeyBETMDSUMTWYKRE-DYTRJAOYSA-N
MW292.43 g/mol
LogP5.33
Rot. Bonds1

About 2,2-dimethyl-N-(2,4,6-trimethylphenyl)-1,3-dihydroquinolin-4-imine

2,2-dimethyl-N-(2,4,6-trimethylphenyl)-1,3-dihydroquinolin-4-imine (PubChem CID 139257919) has the molecular formula C20H24N2 and a molecular weight of 292.43 g/mol. Its IUPAC name is 2,2-dimethyl-N-(2,4,6-trimethylphenyl)-1,3-dihydroquinolin-4-imine.

Molecular Properties

Compound Name2,2-dimethyl-N-(2,4,6-trimethylphenyl)-1,3-dihydroquinolin-4-imine
PubChem CID139257919
Molecular FormulaC20H24N2
Molecular Weight292.43 g/mol
Exact Mass292.19
IUPAC Name2,2-dimethyl-N-(2,4,6-trimethylphenyl)-1,3-dihydroquinolin-4-imine
SMILESCc1cc(C)c(/N=C2\CC(C)(C)Nc3ccccc32)c(C)c1
InChIInChI=1S/C20H24N2/c1-13-10-14(2)19(15(3)11-13)21-18-12-20(4,5)22-17-9-7-6-8-16(17)18/h6-11,22H,12H2,1-5H3/b21-18+
InChIKeyBETMDSUMTWYKRE-DYTRJAOYSA-N
XLogP5.33
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500292.43
LogP ≤ 55.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(3,4-dimethylphenyl)-2,2-dimethyl-1,3-dihydroquinolin-4-imine
CID 136869903
2,2-dimethyl-1,3-dihydroindole;ethane
CID 90930598
2-N-(2,6-dimethylphenyl)-3-N-(2,4,6-trimethylphenyl)-1,4-dithiane-2,3-diimine
CID 20582762
2,2,4-trimethyl-1,3-dihydroindeno[1,2-g]quinoline
CID 23433640
2,2-dimethyl-1,3-dihydroquinazolin-4-one
CID 595161
1-N,2-N-bis(2,4,6-trimethylphenyl)acenaphthylene-1,2-diimine;bromonickel;carbanide
CID 20789300
(2,2,6-trimethyl-1,3-dihydroindol-4-yl)boronic acid
CID 145450564
2,2,4-trimethyl-1H-quinoline;hydrochloride
CID 6602975
6-chloro-2,2-dimethyl-1,3-dihydroindole
CID 84718600
1',3'-dimethyl-9,9'-spirobi[fluorene]
CID 169054935
1,3,5-trimethyl-2-(2-phosphorosophenyl)benzene
CID 68744972
6-fluoro-2,2-dimethyl-1,3-dihydroindole
CID 84717066

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-(2,4,6-trimethylphenyl)-1,3-dihydroquinolin-4-imine?
The IUPAC name of 2,2-dimethyl-N-(2,4,6-trimethylphenyl)-1,3-dihydroquinolin-4-imine (CID 139257919) is 2,2-dimethyl-N-(2,4,6-trimethylphenyl)-1,3-dihydroquinolin-4-imine.
What is the SMILES notation for 2,2-dimethyl-N-(2,4,6-trimethylphenyl)-1,3-dihydroquinolin-4-imine?
The canonical SMILES for 2,2-dimethyl-N-(2,4,6-trimethylphenyl)-1,3-dihydroquinolin-4-imine is Cc1cc(C)c(/N=C2\CC(C)(C)Nc3ccccc32)c(C)c1.
What is the InChIKey of 2,2-dimethyl-N-(2,4,6-trimethylphenyl)-1,3-dihydroquinolin-4-imine?
The InChIKey is BETMDSUMTWYKRE-DYTRJAOYSA-N. The full InChI is InChI=1S/C20H24N2/c1-13-10-14(2)19(15(3)11-13)21-18-12-20(4,5)22-17-9-7-6-8-16(17)18/h6-11,22H,12H2,1-5H3/b21-18+.
What are the key properties of 2,2-dimethyl-N-(2,4,6-trimethylphenyl)-1,3-dihydroquinolin-4-imine?
2,2-dimethyl-N-(2,4,6-trimethylphenyl)-1,3-dihydroquinolin-4-imine has a molecular weight of 292.43 g/mol, XLogP of 5.33, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-(2,4,6-trimethylphenyl)-1,3-dihydroquinolin-4-imine is sourced from PubChem (CID 139257919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).