2-(6-amino-5-phenylpyridazin-3-yl)phenol

C16H13N3O — CID 137045897

IUPAC2-(6-amino-5-phenylpyridazin-3-yl)phenol
SMILESNc1nnc(-c2ccccc2O)cc1-c1ccccc1
InChIInChI=1S/C16H13N3O/c17-16-13(11-6-2-1-3-7-11)10-14(18-19-16)12-8-4-5-9-15(12)20/h1-10,20H,(H2,17,19)
InChIKeySDAWPVIWTVUTCC-UHFFFAOYSA-N
MW263.30 g/mol
LogP3.10
Rot. Bonds2

About 2-(6-amino-5-phenylpyridazin-3-yl)phenol

2-(6-amino-5-phenylpyridazin-3-yl)phenol (PubChem CID 137045897) has the molecular formula C16H13N3O and a molecular weight of 263.30 g/mol. Its IUPAC name is 2-(6-amino-5-phenylpyridazin-3-yl)phenol.

Molecular Properties

Compound Name2-(6-amino-5-phenylpyridazin-3-yl)phenol
PubChem CID137045897
Molecular FormulaC16H13N3O
Molecular Weight263.30 g/mol
Exact Mass263.11
IUPAC Name2-(6-amino-5-phenylpyridazin-3-yl)phenol
SMILESNc1nnc(-c2ccccc2O)cc1-c1ccccc1
InChIInChI=1S/C16H13N3O/c17-16-13(11-6-2-1-3-7-11)10-14(18-19-16)12-8-4-5-9-15(12)20/h1-10,20H,(H2,17,19)
InChIKeySDAWPVIWTVUTCC-UHFFFAOYSA-N
XLogP3.10
TPSA72.03 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.30
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(6-amino-5-phenylpyridazin-3-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

Smarca2/4-IN-2
CID 136145607
2-(6-Amino-5-phenyl-pyridazin-3-yl)-4-fluoro-phenol
CID 137029413
US10308614, Example 231
CID 137029431
US10308614, Example 232
CID 137029433
2-(6-Amino-5-phenylpyridazin-3-yl)-3-fluorophenol
CID 137045915
2-(6-Amino-5-phenylpyridazin-3-yl)-6-fluorophenol
CID 137045957
Phenol, 4-(6-amino-5-methyl-3-pyridazinyl)-, monohydrochloride
CID 135770315
2-(6-(Methylamino)pyridazin-3-yl)phenol
CID 136145557
US10308614, Example 189
CID 137029365
US10308614, Example 210
CID 137029376
US10308614, Example 213
CID 137029389
US10308614, Example 223
CID 137029397

Frequently Asked Questions

What is the IUPAC name of 2-(6-amino-5-phenylpyridazin-3-yl)phenol?
The IUPAC name of 2-(6-amino-5-phenylpyridazin-3-yl)phenol (CID 137045897) is 2-(6-amino-5-phenylpyridazin-3-yl)phenol.
What is the SMILES notation for 2-(6-amino-5-phenylpyridazin-3-yl)phenol?
The canonical SMILES for 2-(6-amino-5-phenylpyridazin-3-yl)phenol is Nc1nnc(-c2ccccc2O)cc1-c1ccccc1.
What is the InChIKey of 2-(6-amino-5-phenylpyridazin-3-yl)phenol?
The InChIKey is SDAWPVIWTVUTCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N3O/c17-16-13(11-6-2-1-3-7-11)10-14(18-19-16)12-8-4-5-9-15(12)20/h1-10,20H,(H2,17,19).
What are the key properties of 2-(6-amino-5-phenylpyridazin-3-yl)phenol?
2-(6-amino-5-phenylpyridazin-3-yl)phenol has a molecular weight of 263.30 g/mol, XLogP of 3.10, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-amino-5-phenylpyridazin-3-yl)phenol is sourced from PubChem (CID 137045897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).