2,3,5,6-tetramethylaniline

C10H15N — CID 3456097

IUPAC2,3,5,6-tetramethylaniline
SMILESCc1cc(C)c(C)c(N)c1C
InChIInChI=1S/C10H15N/c1-6-5-7(2)9(4)10(11)8(6)3/h5H,11H2,1-4H3
InChIKeyZCZPJZYQBNOPLT-UHFFFAOYSA-N
MW149.24 g/mol
LogP2.50
Rot. Bonds

About 2,3,5,6-tetramethylaniline

2,3,5,6-tetramethylaniline (PubChem CID 3456097) has the molecular formula C10H15N and a molecular weight of 149.24 g/mol. Its IUPAC name is 2,3,5,6-tetramethylaniline.

Molecular Properties

Compound Name2,3,5,6-tetramethylaniline
PubChem CID3456097
Molecular FormulaC10H15N
Molecular Weight149.24 g/mol
Exact Mass149.12
IUPAC Name2,3,5,6-tetramethylaniline
SMILESCc1cc(C)c(C)c(N)c1C
InChIInChI=1S/C10H15N/c1-6-5-7(2)9(4)10(11)8(6)3/h5H,11H2,1-4H3
InChIKeyZCZPJZYQBNOPLT-UHFFFAOYSA-N
XLogP2.50
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.24
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2,3,5,6-tetramethylaniline?
The IUPAC name of 2,3,5,6-tetramethylaniline (CID 3456097) is 2,3,5,6-tetramethylaniline.
What is the SMILES notation for 2,3,5,6-tetramethylaniline?
The canonical SMILES for 2,3,5,6-tetramethylaniline is Cc1cc(C)c(C)c(N)c1C.
What is the InChIKey of 2,3,5,6-tetramethylaniline?
The InChIKey is ZCZPJZYQBNOPLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N/c1-6-5-7(2)9(4)10(11)8(6)3/h5H,11H2,1-4H3.
What are the key properties of 2,3,5,6-tetramethylaniline?
2,3,5,6-tetramethylaniline has a molecular weight of 149.24 g/mol, XLogP of 2.50, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,5,6-tetramethylaniline is sourced from PubChem (CID 3456097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).