N-(2,5-dimethylphenyl)-N,2,3,4,5,6-hexamethylaniline

C20H27N — CID 134561466

IUPACN-(2,5-dimethylphenyl)-N,2,3,4,5,6-hexamethylaniline
SMILESCc1ccc(C)c(N(C)c2c(C)c(C)c(C)c(C)c2C)c1
InChIInChI=1S/C20H27N/c1-12-9-10-13(2)19(11-12)21(8)20-17(6)15(4)14(3)16(5)18(20)7/h9-11H,1-8H3
InChIKeyOKIQYGGBKLLQIN-UHFFFAOYSA-N
MW281.44 g/mol
LogP5.61
Rot. Bonds2

About N-(2,5-dimethylphenyl)-N,2,3,4,5,6-hexamethylaniline

N-(2,5-dimethylphenyl)-N,2,3,4,5,6-hexamethylaniline (PubChem CID 134561466) has the molecular formula C20H27N and a molecular weight of 281.44 g/mol. Its IUPAC name is N-(2,5-dimethylphenyl)-N,2,3,4,5,6-hexamethylaniline.

Molecular Properties

Compound NameN-(2,5-dimethylphenyl)-N,2,3,4,5,6-hexamethylaniline
PubChem CID134561466
Molecular FormulaC20H27N
Molecular Weight281.44 g/mol
Exact Mass281.21
IUPAC NameN-(2,5-dimethylphenyl)-N,2,3,4,5,6-hexamethylaniline
SMILESCc1ccc(C)c(N(C)c2c(C)c(C)c(C)c(C)c2C)c1
InChIInChI=1S/C20H27N/c1-12-9-10-13(2)19(11-12)21(8)20-17(6)15(4)14(3)16(5)18(20)7/h9-11H,1-8H3
InChIKeyOKIQYGGBKLLQIN-UHFFFAOYSA-N
XLogP5.61
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500281.44
LogP ≤ 55.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze N-(2,5-dimethylphenyl)-N,2,3,4,5,6-hexamethylaniline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2,5-dimethylphenyl)-N,2,4,6-tetramethylaniline
CID 134561467
4-N-(2,5-dimethylphenyl)-1-N,4-N-dimethylbenzene-1,4-diamine
CID 117029058
N,N-bis(2,5-dimethylphenyl)-2,6-dimethylaniline
CID 164803656
N,2,3,5,6-pentamethyl-N-(2-methylphenyl)aniline
CID 163538008
N,2,3,5,6-pentamethyl-N-(2,3,4-trimethylphenyl)aniline
CID 163804282
N-(2,3-dimethylphenyl)-N,2,4,5-tetramethylaniline;N-(2,4-dimethylphenyl)-N,2,4,5-tetramethylaniline;N-(2,5-dimethylphenyl)-N,2,4,5-tetramethylaniline;N,2,3,4,5,6-hexamethyl-N-(2,3,4,5,6-pentamethylphenyl)aniline;N,2,4,5-tetramethyl-N-(2-methylphenyl)aniline;N,2,4,5-tetramethyl-N-(3-methylphenyl)aniline;N,2,4,5-tetramethyl-N-(4-methylphenyl)aniline;N,2,4,5-tetramethyl-N-phenylaniline
CID 163741286
1-chloro-1-(2,5-dimethylphenyl)hydrazine
CID 88866189
N,2,3,4,5,6-hexamethyl-N-(2,3,4,5,6-pentamethylphenyl)aniline
CID 58722053
1-(N,2,5-trimethylanilino)propan-2-ol
CID 82112048
2,5-dimethyl-N,N-dipropylaniline
CID 13113808
1-N,4-dimethyl-1-N-(2,3,4-trimethylphenyl)benzene-1,2-diamine
CID 115125026
N-benzyl-N,2,5-trimethylaniline
CID 15439716

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethylphenyl)-N,2,3,4,5,6-hexamethylaniline?
The IUPAC name of N-(2,5-dimethylphenyl)-N,2,3,4,5,6-hexamethylaniline (CID 134561466) is N-(2,5-dimethylphenyl)-N,2,3,4,5,6-hexamethylaniline.
What is the SMILES notation for N-(2,5-dimethylphenyl)-N,2,3,4,5,6-hexamethylaniline?
The canonical SMILES for N-(2,5-dimethylphenyl)-N,2,3,4,5,6-hexamethylaniline is Cc1ccc(C)c(N(C)c2c(C)c(C)c(C)c(C)c2C)c1.
What is the InChIKey of N-(2,5-dimethylphenyl)-N,2,3,4,5,6-hexamethylaniline?
The InChIKey is OKIQYGGBKLLQIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N/c1-12-9-10-13(2)19(11-12)21(8)20-17(6)15(4)14(3)16(5)18(20)7/h9-11H,1-8H3.
What are the key properties of N-(2,5-dimethylphenyl)-N,2,3,4,5,6-hexamethylaniline?
N-(2,5-dimethylphenyl)-N,2,3,4,5,6-hexamethylaniline has a molecular weight of 281.44 g/mol, XLogP of 5.61, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethylphenyl)-N,2,3,4,5,6-hexamethylaniline is sourced from PubChem (CID 134561466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).