4-(5-amino-1,2-oxazol-3-yl)-3-methylphenol

C10H10N2O2 — CID 137012596

IUPAC4-(5-amino-1,2-oxazol-3-yl)-3-methylphenol
SMILESCc1cc(O)ccc1-c1cc(N)on1
InChIInChI=1S/C10H10N2O2/c1-6-4-7(13)2-3-8(6)9-5-10(11)14-12-9/h2-5,13H,11H2,1H3
InChIKeyPKRFDILQWWOFFZ-UHFFFAOYSA-N
MW190.20 g/mol
LogP1.94
Rot. Bonds1

About 4-(5-amino-1,2-oxazol-3-yl)-3-methylphenol

4-(5-amino-1,2-oxazol-3-yl)-3-methylphenol (PubChem CID 137012596) has the molecular formula C10H10N2O2 and a molecular weight of 190.20 g/mol. Its IUPAC name is 4-(5-amino-1,2-oxazol-3-yl)-3-methylphenol.

Molecular Properties

Compound Name4-(5-amino-1,2-oxazol-3-yl)-3-methylphenol
PubChem CID137012596
Molecular FormulaC10H10N2O2
Molecular Weight190.20 g/mol
Exact Mass190.07
IUPAC Name4-(5-amino-1,2-oxazol-3-yl)-3-methylphenol
SMILESCc1cc(O)ccc1-c1cc(N)on1
InChIInChI=1S/C10H10N2O2/c1-6-4-7(13)2-3-8(6)9-5-10(11)14-12-9/h2-5,13H,11H2,1H3
InChIKeyPKRFDILQWWOFFZ-UHFFFAOYSA-N
XLogP1.94
TPSA72.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.20
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(5-amino-1,2-oxazol-3-yl)-3-methylphenol?
The IUPAC name of 4-(5-amino-1,2-oxazol-3-yl)-3-methylphenol (CID 137012596) is 4-(5-amino-1,2-oxazol-3-yl)-3-methylphenol.
What is the SMILES notation for 4-(5-amino-1,2-oxazol-3-yl)-3-methylphenol?
The canonical SMILES for 4-(5-amino-1,2-oxazol-3-yl)-3-methylphenol is Cc1cc(O)ccc1-c1cc(N)on1.
What is the InChIKey of 4-(5-amino-1,2-oxazol-3-yl)-3-methylphenol?
The InChIKey is PKRFDILQWWOFFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O2/c1-6-4-7(13)2-3-8(6)9-5-10(11)14-12-9/h2-5,13H,11H2,1H3.
What are the key properties of 4-(5-amino-1,2-oxazol-3-yl)-3-methylphenol?
4-(5-amino-1,2-oxazol-3-yl)-3-methylphenol has a molecular weight of 190.20 g/mol, XLogP of 1.94, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-amino-1,2-oxazol-3-yl)-3-methylphenol is sourced from PubChem (CID 137012596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).