2-(2,5-dimethylphenyl)-6-methylaniline

C15H17N — CID 23622687

IUPAC2-(2,5-dimethylphenyl)-6-methylaniline
SMILESCc1ccc(C)c(-c2cccc(C)c2N)c1
InChIInChI=1S/C15H17N/c1-10-7-8-11(2)14(9-10)13-6-4-5-12(3)15(13)16/h4-9H,16H2,1-3H3
InChIKeyTXKMUQMMJZKBHQ-UHFFFAOYSA-N
MW211.31 g/mol
LogP3.86
Rot. Bonds1

About 2-(2,5-dimethylphenyl)-6-methylaniline

2-(2,5-dimethylphenyl)-6-methylaniline (PubChem CID 23622687) has the molecular formula C15H17N and a molecular weight of 211.31 g/mol. Its IUPAC name is 2-(2,5-dimethylphenyl)-6-methylaniline.

Molecular Properties

Compound Name2-(2,5-dimethylphenyl)-6-methylaniline
PubChem CID23622687
Molecular FormulaC15H17N
Molecular Weight211.31 g/mol
Exact Mass211.14
IUPAC Name2-(2,5-dimethylphenyl)-6-methylaniline
SMILESCc1ccc(C)c(-c2cccc(C)c2N)c1
InChIInChI=1S/C15H17N/c1-10-7-8-11(2)14(9-10)13-6-4-5-12(3)15(13)16/h4-9H,16H2,1-3H3
InChIKeyTXKMUQMMJZKBHQ-UHFFFAOYSA-N
XLogP3.86
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

butane;1,4-dimethyl-2-(2-methylphenyl)benzene
CID 142975298
2-[[2,6-bis(2,5-dimethylphenyl)phenyl]disulfanyl]-1,3-bis(2,5-dimethylphenyl)benzene
CID 87490839
2-(2-fluorophenyl)-1,4-dimethylbenzene
CID 66641436
3-(2,4-dimethylphenyl)-4-methylaniline
CID 63334523
1,4-dimethyl-2-(2-methylphenyl)benzene;methane;2-methylnaphthalene
CID 143438669
2,3-dimethyl-6-(2-methylphenyl)aniline
CID 141449762
dichloroiron;2,6-dimethylaniline
CID 175869472
3-(2,5-dimethylphenyl)-4-methoxyaniline
CID 39247090
2-amino-4-(2,5-dimethylphenyl)-6-(2-methylphenyl)pyridine-3-carbonitrile
CID 5230497
1,3-dichloro-2-(2,5-dimethylphenyl)benzene
CID 66641397
4-(2,5-dimethylphenyl)-2,3-dihydro-1H-inden-1-amine
CID 114081048
1-(2,5-dimethylphenyl)-9H-fluoren-9-ol
CID 141056407

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylphenyl)-6-methylaniline?
The IUPAC name of 2-(2,5-dimethylphenyl)-6-methylaniline (CID 23622687) is 2-(2,5-dimethylphenyl)-6-methylaniline.
What is the SMILES notation for 2-(2,5-dimethylphenyl)-6-methylaniline?
The canonical SMILES for 2-(2,5-dimethylphenyl)-6-methylaniline is Cc1ccc(C)c(-c2cccc(C)c2N)c1.
What is the InChIKey of 2-(2,5-dimethylphenyl)-6-methylaniline?
The InChIKey is TXKMUQMMJZKBHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N/c1-10-7-8-11(2)14(9-10)13-6-4-5-12(3)15(13)16/h4-9H,16H2,1-3H3.
What are the key properties of 2-(2,5-dimethylphenyl)-6-methylaniline?
2-(2,5-dimethylphenyl)-6-methylaniline has a molecular weight of 211.31 g/mol, XLogP of 3.86, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylphenyl)-6-methylaniline is sourced from PubChem (CID 23622687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).