N-(2,3-dimethylphenyl)-3,6-dimethyl-2-(propan-2-ylideneamino)aniline

C19H24N2 — CID 142887486

IUPACN-(2,3-dimethylphenyl)-3,6-dimethyl-2-(propan-2-ylideneamino)aniline
SMILESCC(C)=Nc1c(C)ccc(C)c1Nc1cccc(C)c1C
InChIInChI=1S/C19H24N2/c1-12(2)20-18-14(4)10-11-15(5)19(18)21-17-9-7-8-13(3)16(17)6/h7-11,21H,1-6H3
InChIKeyCSKWDNZEBCBJJH-UHFFFAOYSA-N
MW280.42 g/mol
LogP5.78
Rot. Bonds3

About N-(2,3-dimethylphenyl)-3,6-dimethyl-2-(propan-2-ylideneamino)aniline

N-(2,3-dimethylphenyl)-3,6-dimethyl-2-(propan-2-ylideneamino)aniline (PubChem CID 142887486) has the molecular formula C19H24N2 and a molecular weight of 280.42 g/mol. Its IUPAC name is N-(2,3-dimethylphenyl)-3,6-dimethyl-2-(propan-2-ylideneamino)aniline.

Molecular Properties

Compound NameN-(2,3-dimethylphenyl)-3,6-dimethyl-2-(propan-2-ylideneamino)aniline
PubChem CID142887486
Molecular FormulaC19H24N2
Molecular Weight280.42 g/mol
Exact Mass280.19
IUPAC NameN-(2,3-dimethylphenyl)-3,6-dimethyl-2-(propan-2-ylideneamino)aniline
SMILESCC(C)=Nc1c(C)ccc(C)c1Nc1cccc(C)c1C
InChIInChI=1S/C19H24N2/c1-12(2)20-18-14(4)10-11-15(5)19(18)21-17-9-7-8-13(3)16(17)6/h7-11,21H,1-6H3
InChIKeyCSKWDNZEBCBJJH-UHFFFAOYSA-N
XLogP5.78
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500280.42
LogP ≤ 55.78
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

sodium 2-(2,3-dimethylanilino)-3-methylbenzoate
CID 23680214
2,3-dimethyl-N-phenylaniline
CID 14952469
copper 2-(2,3-dimethylanilino)benzoate
CID 135564277
2-(2,3-dimethylanilino)benzaldehyde
CID 15027376
3-methyl-2-(propan-2-ylideneamino)benzamide;hydrochloride
CID 141084680
benzene;1,2,3-trimethylbenzene
CID 159605245
ethane;1,2,3-trimethylbenzene
CID 54068667
3-(2,6-dimethylanilino)-N-(2,3-dimethylphenyl)propanamide
CID 109035849
phosphenous acid;1,2,3-trimethylbenzene
CID 174913168
2-[2-(2,3-dimethylanilino)phenyl]acetic acid
CID 14762938
2-N-(3-bromo-2-methylphenyl)-3-methylbenzene-1,2-diamine
CID 107633682
N-(2,3,4-trimethylphenyl)propan-2-imine
CID 20769409

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylphenyl)-3,6-dimethyl-2-(propan-2-ylideneamino)aniline?
The IUPAC name of N-(2,3-dimethylphenyl)-3,6-dimethyl-2-(propan-2-ylideneamino)aniline (CID 142887486) is N-(2,3-dimethylphenyl)-3,6-dimethyl-2-(propan-2-ylideneamino)aniline.
What is the SMILES notation for N-(2,3-dimethylphenyl)-3,6-dimethyl-2-(propan-2-ylideneamino)aniline?
The canonical SMILES for N-(2,3-dimethylphenyl)-3,6-dimethyl-2-(propan-2-ylideneamino)aniline is CC(C)=Nc1c(C)ccc(C)c1Nc1cccc(C)c1C.
What is the InChIKey of N-(2,3-dimethylphenyl)-3,6-dimethyl-2-(propan-2-ylideneamino)aniline?
The InChIKey is CSKWDNZEBCBJJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2/c1-12(2)20-18-14(4)10-11-15(5)19(18)21-17-9-7-8-13(3)16(17)6/h7-11,21H,1-6H3.
What are the key properties of N-(2,3-dimethylphenyl)-3,6-dimethyl-2-(propan-2-ylideneamino)aniline?
N-(2,3-dimethylphenyl)-3,6-dimethyl-2-(propan-2-ylideneamino)aniline has a molecular weight of 280.42 g/mol, XLogP of 5.78, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylphenyl)-3,6-dimethyl-2-(propan-2-ylideneamino)aniline is sourced from PubChem (CID 142887486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).