6-(3-aminophenyl)-2,3-dimethylaniline

C14H16N2 — CID 68785658

IUPAC6-(3-aminophenyl)-2,3-dimethylaniline
SMILESCc1ccc(-c2cccc(N)c2)c(N)c1C
InChIInChI=1S/C14H16N2/c1-9-6-7-13(14(16)10(9)2)11-4-3-5-12(15)8-11/h3-8H,15-16H2,1-2H3
InChIKeyFRSMXYRPUZSPAY-UHFFFAOYSA-N
MW212.30 g/mol
LogP3.13
Rot. Bonds1

About 6-(3-aminophenyl)-2,3-dimethylaniline

6-(3-aminophenyl)-2,3-dimethylaniline (PubChem CID 68785658) has the molecular formula C14H16N2 and a molecular weight of 212.30 g/mol. Its IUPAC name is 6-(3-aminophenyl)-2,3-dimethylaniline.

Molecular Properties

Compound Name6-(3-aminophenyl)-2,3-dimethylaniline
PubChem CID68785658
Molecular FormulaC14H16N2
Molecular Weight212.30 g/mol
Exact Mass212.13
IUPAC Name6-(3-aminophenyl)-2,3-dimethylaniline
SMILESCc1ccc(-c2cccc(N)c2)c(N)c1C
InChIInChI=1S/C14H16N2/c1-9-6-7-13(14(16)10(9)2)11-4-3-5-12(15)8-11/h3-8H,15-16H2,1-2H3
InChIKeyFRSMXYRPUZSPAY-UHFFFAOYSA-N
XLogP3.13
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.30
LogP ≤ 53.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6-(3-aminophenyl)-2,3-dimethylaniline?
The IUPAC name of 6-(3-aminophenyl)-2,3-dimethylaniline (CID 68785658) is 6-(3-aminophenyl)-2,3-dimethylaniline.
What is the SMILES notation for 6-(3-aminophenyl)-2,3-dimethylaniline?
The canonical SMILES for 6-(3-aminophenyl)-2,3-dimethylaniline is Cc1ccc(-c2cccc(N)c2)c(N)c1C.
What is the InChIKey of 6-(3-aminophenyl)-2,3-dimethylaniline?
The InChIKey is FRSMXYRPUZSPAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2/c1-9-6-7-13(14(16)10(9)2)11-4-3-5-12(15)8-11/h3-8H,15-16H2,1-2H3.
What are the key properties of 6-(3-aminophenyl)-2,3-dimethylaniline?
6-(3-aminophenyl)-2,3-dimethylaniline has a molecular weight of 212.30 g/mol, XLogP of 3.13, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-aminophenyl)-2,3-dimethylaniline is sourced from PubChem (CID 68785658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).