2-(5-amino-1,2-oxazol-3-yl)benzene-1,3-diol

C9H8N2O3 — CID 137015303

IUPAC2-(5-amino-1,2-oxazol-3-yl)benzene-1,3-diol
SMILESNc1cc(-c2c(O)cccc2O)no1
InChIInChI=1S/C9H8N2O3/c10-8-4-5(11-14-8)9-6(12)2-1-3-7(9)13/h1-4,12-13H,10H2
InChIKeyNZWMMEHZLRFCMY-UHFFFAOYSA-N
MW192.17 g/mol
LogP1.34
Rot. Bonds1

About 2-(5-amino-1,2-oxazol-3-yl)benzene-1,3-diol

2-(5-amino-1,2-oxazol-3-yl)benzene-1,3-diol (PubChem CID 137015303) has the molecular formula C9H8N2O3 and a molecular weight of 192.17 g/mol. Its IUPAC name is 2-(5-amino-1,2-oxazol-3-yl)benzene-1,3-diol.

Molecular Properties

Compound Name2-(5-amino-1,2-oxazol-3-yl)benzene-1,3-diol
PubChem CID137015303
Molecular FormulaC9H8N2O3
Molecular Weight192.17 g/mol
Exact Mass192.05
IUPAC Name2-(5-amino-1,2-oxazol-3-yl)benzene-1,3-diol
SMILESNc1cc(-c2c(O)cccc2O)no1
InChIInChI=1S/C9H8N2O3/c10-8-4-5(11-14-8)9-6(12)2-1-3-7(9)13/h1-4,12-13H,10H2
InChIKeyNZWMMEHZLRFCMY-UHFFFAOYSA-N
XLogP1.34
TPSA92.51 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.17
LogP ≤ 51.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 2-(5-amino-1,2-oxazol-3-yl)benzene-1,3-diol 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

3-(5-amino-1,2-oxazol-3-yl)-1,2-dimethylindol-7-ol
CID 115108539
4-(5-amino-1,2-oxazol-3-yl)benzene-1,3-diol
CID 137015302
3-(5-amino-1,2-oxazol-3-yl)-1H-indol-7-ol
CID 136985951
3-(5-amino-1,2-oxazol-3-yl)-1H-indol-4-ol
CID 136986010
3-(2,3,4,5,6-pentafluorophenyl)-1,2-oxazol-5-amine
CID 43608008
2-(5-amino-1,2-oxazol-3-yl)-5-methylbenzene-1,4-diol
CID 136998676
2-(5-amino-1,2-oxazol-3-yl)-5-bromo-3,6-dimethylphenol
CID 136931070
4-(5-amino-1,2-oxazol-3-yl)-2-bromo-3,5-dimethylphenol
CID 136931065
4-(5-amino-1,2-oxazol-3-yl)-2-chloro-3,5-difluorophenol
CID 137011591
3-(3-chlorophenyl)-1,2-oxazol-5-amine
CID 3382841
3-(5-amino-1,2-oxazol-3-yl)-2,4-difluoro-5-methoxyphenol
CID 117356931
2-(5-amino-1,2-oxazol-3-yl)-3-bromo-6-methoxyphenol
CID 136931170

Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-1,2-oxazol-3-yl)benzene-1,3-diol?
The IUPAC name of 2-(5-amino-1,2-oxazol-3-yl)benzene-1,3-diol (CID 137015303) is 2-(5-amino-1,2-oxazol-3-yl)benzene-1,3-diol.
What is the SMILES notation for 2-(5-amino-1,2-oxazol-3-yl)benzene-1,3-diol?
The canonical SMILES for 2-(5-amino-1,2-oxazol-3-yl)benzene-1,3-diol is Nc1cc(-c2c(O)cccc2O)no1.
What is the InChIKey of 2-(5-amino-1,2-oxazol-3-yl)benzene-1,3-diol?
The InChIKey is NZWMMEHZLRFCMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2O3/c10-8-4-5(11-14-8)9-6(12)2-1-3-7(9)13/h1-4,12-13H,10H2.
What are the key properties of 2-(5-amino-1,2-oxazol-3-yl)benzene-1,3-diol?
2-(5-amino-1,2-oxazol-3-yl)benzene-1,3-diol has a molecular weight of 192.17 g/mol, XLogP of 1.34, 1 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-1,2-oxazol-3-yl)benzene-1,3-diol is sourced from PubChem (CID 137015303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).