3-(5-amino-1,2-oxazol-3-yl)-1H-indol-4-ol

C11H9N3O2 — CID 136986010

IUPAC3-(5-amino-1,2-oxazol-3-yl)-1H-indol-4-ol
SMILESNc1cc(-c2c[nH]c3cccc(O)c23)no1
InChIInChI=1S/C11H9N3O2/c12-10-4-8(14-16-10)6-5-13-7-2-1-3-9(15)11(6)7/h1-5,13,15H,12H2
InChIKeyTUXDPRRYSKLNJG-UHFFFAOYSA-N
MW215.21 g/mol
LogP2.11
Rot. Bonds1

About 3-(5-amino-1,2-oxazol-3-yl)-1H-indol-4-ol

3-(5-amino-1,2-oxazol-3-yl)-1H-indol-4-ol (PubChem CID 136986010) has the molecular formula C11H9N3O2 and a molecular weight of 215.21 g/mol. Its IUPAC name is 3-(5-amino-1,2-oxazol-3-yl)-1H-indol-4-ol.

Molecular Properties

Compound Name3-(5-amino-1,2-oxazol-3-yl)-1H-indol-4-ol
PubChem CID136986010
Molecular FormulaC11H9N3O2
Molecular Weight215.21 g/mol
Exact Mass215.07
IUPAC Name3-(5-amino-1,2-oxazol-3-yl)-1H-indol-4-ol
SMILESNc1cc(-c2c[nH]c3cccc(O)c23)no1
InChIInChI=1S/C11H9N3O2/c12-10-4-8(14-16-10)6-5-13-7-2-1-3-9(15)11(6)7/h1-5,13,15H,12H2
InChIKeyTUXDPRRYSKLNJG-UHFFFAOYSA-N
XLogP2.11
TPSA88.07 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.21
LogP ≤ 52.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

3-(3-chloro-1H-indol-4-yl)-1,2-oxazol-5-amine
CID 117339578
3-(5-amino-1,2-oxazol-3-yl)-1H-indol-7-ol
CID 136985951
2-(5-amino-1,2-oxazol-3-yl)benzene-1,3-diol
CID 137015303
4-(5-amino-1,2-oxazol-3-yl)benzene-1,3-diol
CID 137015302
3-(4-fluoro-1H-indol-3-yl)-1,2-oxazole-5-carboxylic acid
CID 136986002
3-(4-bromo-1H-indol-3-yl)-1,2-oxazole-5-carboxylic acid
CID 136986004
2-(5-amino-1,2-oxazol-3-yl)-5-methylbenzene-1,4-diol
CID 136998676
3-[4-(trifluoromethyl)-1H-indol-3-yl]-1,2-oxazole-5-carboxylic acid
CID 136985992
3-(2-methyl-1-benzofuran-7-yl)-1,2-oxazol-5-amine
CID 117305291
6-(5-amino-1,2-oxazol-3-yl)-2-fluoro-3-methylphenol
CID 136998707
2-(5-amino-1,2-oxazol-3-yl)-4-(fluoromethyl)phenol
CID 136998708
4-(5-amino-1,2-oxazol-3-yl)-3-methylphenol
CID 137012596

Frequently Asked Questions

What is the IUPAC name of 3-(5-amino-1,2-oxazol-3-yl)-1H-indol-4-ol?
The IUPAC name of 3-(5-amino-1,2-oxazol-3-yl)-1H-indol-4-ol (CID 136986010) is 3-(5-amino-1,2-oxazol-3-yl)-1H-indol-4-ol.
What is the SMILES notation for 3-(5-amino-1,2-oxazol-3-yl)-1H-indol-4-ol?
The canonical SMILES for 3-(5-amino-1,2-oxazol-3-yl)-1H-indol-4-ol is Nc1cc(-c2c[nH]c3cccc(O)c23)no1.
What is the InChIKey of 3-(5-amino-1,2-oxazol-3-yl)-1H-indol-4-ol?
The InChIKey is TUXDPRRYSKLNJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N3O2/c12-10-4-8(14-16-10)6-5-13-7-2-1-3-9(15)11(6)7/h1-5,13,15H,12H2.
What are the key properties of 3-(5-amino-1,2-oxazol-3-yl)-1H-indol-4-ol?
3-(5-amino-1,2-oxazol-3-yl)-1H-indol-4-ol has a molecular weight of 215.21 g/mol, XLogP of 2.11, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-amino-1,2-oxazol-3-yl)-1H-indol-4-ol is sourced from PubChem (CID 136986010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).