2-(5-amino-3H-indol-2-yl)phenol

C14H12N2O — CID 159684413

IUPAC2-(5-amino-3H-indol-2-yl)phenol
SMILESNc1ccc2c(c1)CC(c1ccccc1O)=N2
InChIInChI=1S/C14H12N2O/c15-10-5-6-12-9(7-10)8-13(16-12)11-3-1-2-4-14(11)17/h1-7,17H,8,15H2
InChIKeyUEIGXWHUYDTTLG-UHFFFAOYSA-N
MW224.26 g/mol
LogP2.65
Rot. Bonds1

About 2-(5-amino-3H-indol-2-yl)phenol

2-(5-amino-3H-indol-2-yl)phenol (PubChem CID 159684413) has the molecular formula C14H12N2O and a molecular weight of 224.26 g/mol. Its IUPAC name is 2-(5-amino-3H-indol-2-yl)phenol.

Molecular Properties

Compound Name2-(5-amino-3H-indol-2-yl)phenol
PubChem CID159684413
Molecular FormulaC14H12N2O
Molecular Weight224.26 g/mol
Exact Mass224.09
IUPAC Name2-(5-amino-3H-indol-2-yl)phenol
SMILESNc1ccc2c(c1)CC(c1ccccc1O)=N2
InChIInChI=1S/C14H12N2O/c15-10-5-6-12-9(7-10)8-13(16-12)11-3-1-2-4-14(11)17/h1-7,17H,8,15H2
InChIKeyUEIGXWHUYDTTLG-UHFFFAOYSA-N
XLogP2.65
TPSA58.61 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-(5-amino-3H-indol-2-yl)phenol 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

2-(4-fluorophenyl)-3H-indol-5-amine
CID 176970286
2-(3-methylphenyl)-3H-indol-5-amine
CID 161064268
4-chloro-2-(3H-indol-2-yl)phenol
CID 158565703
5-amino-2-(2-hydroxyphenyl)phenol
CID 22023425
4-(2-hydroxyphenyl)-8-methyl-1,3-dihydro-1,5-benzodiazepin-2-one
CID 135453908
4-(2-hydroxyphenyl)-1,3-dihydro-1,5-benzodiazepin-2-one
CID 3741669
9H-fluoren-2-amine;hydrobromide
CID 141482724
2-[2-(4-tert-butylphenyl)-3H-1,5-benzodiazepin-4-yl]phenol
CID 3472817
5-chloro-2-(4-naphthalen-1-yl-3H-1,5-benzodiazepin-2-yl)phenol
CID 136827439
ethane;9H-fluoren-2-amine
CID 142950354
2-(6-amino-1H-benzimidazol-2-yl)-5-(6-methyl-3H-indol-2-yl)benzene-1,4-diol
CID 159684415
5-chloro-2-phenyl-3H-indole
CID 12835738

Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-3H-indol-2-yl)phenol?
The IUPAC name of 2-(5-amino-3H-indol-2-yl)phenol (CID 159684413) is 2-(5-amino-3H-indol-2-yl)phenol.
What is the SMILES notation for 2-(5-amino-3H-indol-2-yl)phenol?
The canonical SMILES for 2-(5-amino-3H-indol-2-yl)phenol is Nc1ccc2c(c1)CC(c1ccccc1O)=N2.
What is the InChIKey of 2-(5-amino-3H-indol-2-yl)phenol?
The InChIKey is UEIGXWHUYDTTLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O/c15-10-5-6-12-9(7-10)8-13(16-12)11-3-1-2-4-14(11)17/h1-7,17H,8,15H2.
What are the key properties of 2-(5-amino-3H-indol-2-yl)phenol?
2-(5-amino-3H-indol-2-yl)phenol has a molecular weight of 224.26 g/mol, XLogP of 2.65, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-3H-indol-2-yl)phenol is sourced from PubChem (CID 159684413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).