4-(2,6-dimethylphenyl)-2,6-dimethylaniline

C16H19N — CID 155131505

IUPAC4-(2,6-dimethylphenyl)-2,6-dimethylaniline
SMILESCc1cc(-c2c(C)cccc2C)cc(C)c1N
InChIInChI=1S/C16H19N/c1-10-6-5-7-11(2)15(10)14-8-12(3)16(17)13(4)9-14/h5-9H,17H2,1-4H3
InChIKeyUVJARMRWBXDWGI-UHFFFAOYSA-N
MW225.33 g/mol
LogP4.17
Rot. Bonds1

About 4-(2,6-dimethylphenyl)-2,6-dimethylaniline

4-(2,6-dimethylphenyl)-2,6-dimethylaniline (PubChem CID 155131505) has the molecular formula C16H19N and a molecular weight of 225.33 g/mol. Its IUPAC name is 4-(2,6-dimethylphenyl)-2,6-dimethylaniline.

Molecular Properties

Compound Name4-(2,6-dimethylphenyl)-2,6-dimethylaniline
PubChem CID155131505
Molecular FormulaC16H19N
Molecular Weight225.33 g/mol
Exact Mass225.15
IUPAC Name4-(2,6-dimethylphenyl)-2,6-dimethylaniline
SMILESCc1cc(-c2c(C)cccc2C)cc(C)c1N
InChIInChI=1S/C16H19N/c1-10-6-5-7-11(2)15(10)14-8-12(3)16(17)13(4)9-14/h5-9H,17H2,1-4H3
InChIKeyUVJARMRWBXDWGI-UHFFFAOYSA-N
XLogP4.17
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.33
LogP ≤ 54.17
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

2-diazenyl-4-(2,6-dimethylphenyl)-6-methylaniline
CID 89367614
bis(4-(4-amino-3,5-dimethylphenyl)-2,6-dimethylaniline);dihydrochloride
CID 69109128
4-(4-aminophenyl)-2,6-dimethylaniline;hydrochloride
CID 172858062
4-(4-amino-3,5-dimethylphenyl)-2,6-dimethylaniline;hydron;dichloride
CID 51066481
2,6-bis(trideuteriomethyl)aniline
CID 45039069
dichloroiron;2,6-dimethylaniline
CID 175869472
4-(2,6-dichlorophenyl)-2-methylaniline
CID 170906772
2,6-bis(trideuteriomethyl)aniline;hydrochloride
CID 163322682
5-(2,6-dimethylphenyl)-2-fluoro-1-methyl-3-(trifluoromethyl)benzene
CID 170027583
1-chloro-2-(4-fluoro-3-methylphenyl)-3-methylbenzene
CID 66251813
1-chloro-2-(3-chloro-4-methylphenyl)-3-methylbenzene
CID 66252192
1,3-dimethyl-2-(4-methyl-3-phenylphenyl)benzene
CID 168751305

Frequently Asked Questions

What is the IUPAC name of 4-(2,6-dimethylphenyl)-2,6-dimethylaniline?
The IUPAC name of 4-(2,6-dimethylphenyl)-2,6-dimethylaniline (CID 155131505) is 4-(2,6-dimethylphenyl)-2,6-dimethylaniline.
What is the SMILES notation for 4-(2,6-dimethylphenyl)-2,6-dimethylaniline?
The canonical SMILES for 4-(2,6-dimethylphenyl)-2,6-dimethylaniline is Cc1cc(-c2c(C)cccc2C)cc(C)c1N.
What is the InChIKey of 4-(2,6-dimethylphenyl)-2,6-dimethylaniline?
The InChIKey is UVJARMRWBXDWGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N/c1-10-6-5-7-11(2)15(10)14-8-12(3)16(17)13(4)9-14/h5-9H,17H2,1-4H3.
What are the key properties of 4-(2,6-dimethylphenyl)-2,6-dimethylaniline?
4-(2,6-dimethylphenyl)-2,6-dimethylaniline has a molecular weight of 225.33 g/mol, XLogP of 4.17, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,6-dimethylphenyl)-2,6-dimethylaniline is sourced from PubChem (CID 155131505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).