2,4,5-trimethyl-N-(2-methylphenyl)aniline

C16H19N — CID 142357624

IUPAC2,4,5-trimethyl-N-(2-methylphenyl)aniline
SMILESCc1cc(C)c(Nc2ccccc2C)cc1C
InChIInChI=1S/C16H19N/c1-11-7-5-6-8-15(11)17-16-10-13(3)12(2)9-14(16)4/h5-10,17H,1-4H3
InChIKeyQPCYOWYOFKFHPJ-UHFFFAOYSA-N
MW225.33 g/mol
LogP4.66
Rot. Bonds2

About 2,4,5-trimethyl-N-(2-methylphenyl)aniline

2,4,5-trimethyl-N-(2-methylphenyl)aniline (PubChem CID 142357624) has the molecular formula C16H19N and a molecular weight of 225.33 g/mol. Its IUPAC name is 2,4,5-trimethyl-N-(2-methylphenyl)aniline.

Molecular Properties

Compound Name2,4,5-trimethyl-N-(2-methylphenyl)aniline
PubChem CID142357624
Molecular FormulaC16H19N
Molecular Weight225.33 g/mol
Exact Mass225.15
IUPAC Name2,4,5-trimethyl-N-(2-methylphenyl)aniline
SMILESCc1cc(C)c(Nc2ccccc2C)cc1C
InChIInChI=1S/C16H19N/c1-11-7-5-6-8-15(11)17-16-10-13(3)12(2)9-14(16)4/h5-10,17H,1-4H3
InChIKeyQPCYOWYOFKFHPJ-UHFFFAOYSA-N
XLogP4.66
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.33
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,4,5-trimethyl-N-(2,4,5-trimethylphenyl)aniline
CID 152754160
2-methyl-1-N-[4-[N-methyl-4-[2-methyl-4-(2-methylanilino)anilino]anilino]phenyl]-4-N-(2-methylphenyl)benzene-1,4-diamine
CID 170570846
4-N,6-N-bis(2-methylphenyl)pyrimidine-4,6-diamine
CID 112864815
N,2-dimethylaniline
CID 163768915
2-methyl-N-[4-(2-methylphenyl)phenyl]aniline
CID 144650096
1-methyl-N-(2-methylphenyl)pyridin-1-ium-2-amine
CID 170230051
5-chloro-2-methyl-3-N-(2-methylphenyl)benzene-1,3-diamine
CID 154647622
4-methyl-2-(2-methylanilino)benzonitrile
CID 62302441
1,2,4,5-tetramethylbenzene;1,2,3-trimethylbenzene
CID 158486906
2-(2-aminoethyl)-4-fluoro-N-(2-methylphenyl)aniline
CID 82294339
2-methyl-N-[1-(2,4,5-trimethylphenyl)ethyl]aniline
CID 43110111
2-N-(2,4-dimethylphenyl)benzene-1,2-diamine
CID 29067178

Frequently Asked Questions

What is the IUPAC name of 2,4,5-trimethyl-N-(2-methylphenyl)aniline?
The IUPAC name of 2,4,5-trimethyl-N-(2-methylphenyl)aniline (CID 142357624) is 2,4,5-trimethyl-N-(2-methylphenyl)aniline.
What is the SMILES notation for 2,4,5-trimethyl-N-(2-methylphenyl)aniline?
The canonical SMILES for 2,4,5-trimethyl-N-(2-methylphenyl)aniline is Cc1cc(C)c(Nc2ccccc2C)cc1C.
What is the InChIKey of 2,4,5-trimethyl-N-(2-methylphenyl)aniline?
The InChIKey is QPCYOWYOFKFHPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N/c1-11-7-5-6-8-15(11)17-16-10-13(3)12(2)9-14(16)4/h5-10,17H,1-4H3.
What are the key properties of 2,4,5-trimethyl-N-(2-methylphenyl)aniline?
2,4,5-trimethyl-N-(2-methylphenyl)aniline has a molecular weight of 225.33 g/mol, XLogP of 4.66, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,5-trimethyl-N-(2-methylphenyl)aniline is sourced from PubChem (CID 142357624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).