2-(2-aminophenyl)aniline

C12H12N2 — CID 15075

IUPAC2-(2-aminophenyl)aniline
SMILESNc1ccccc1-c1ccccc1N
InChIInChI=1S/C12H12N2/c13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)14/h1-8H,13-14H2
InChIKeyHOLGXWDGCVTMTB-UHFFFAOYSA-N
MW184.24 g/mol
LogP2.52
Rot. Bonds1

About 2-(2-aminophenyl)aniline

2-(2-aminophenyl)aniline (PubChem CID 15075) has the molecular formula C12H12N2 and a molecular weight of 184.24 g/mol. Its IUPAC name is 2-(2-aminophenyl)aniline.

Molecular Properties

Compound Name2-(2-aminophenyl)aniline
PubChem CID15075
Molecular FormulaC12H12N2
Molecular Weight184.24 g/mol
Exact Mass184.10
IUPAC Name2-(2-aminophenyl)aniline
SMILESNc1ccccc1-c1ccccc1N
InChIInChI=1S/C12H12N2/c13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)14/h1-8H,13-14H2
InChIKeyHOLGXWDGCVTMTB-UHFFFAOYSA-N
XLogP2.52
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.24
LogP ≤ 52.52
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 2-(2-aminophenyl)aniline?
The IUPAC name of 2-(2-aminophenyl)aniline (CID 15075) is 2-(2-aminophenyl)aniline.
What is the SMILES notation for 2-(2-aminophenyl)aniline?
The canonical SMILES for 2-(2-aminophenyl)aniline is Nc1ccccc1-c1ccccc1N.
What is the InChIKey of 2-(2-aminophenyl)aniline?
The InChIKey is HOLGXWDGCVTMTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2/c13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)14/h1-8H,13-14H2.
What are the key properties of 2-(2-aminophenyl)aniline?
2-(2-aminophenyl)aniline has a molecular weight of 184.24 g/mol, XLogP of 2.52, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminophenyl)aniline is sourced from PubChem (CID 15075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).