4-(3,5-dimethyl-1,2-oxazol-4-yl)phenol

C11H11NO2 — CID 11651288

IUPAC4-(3,5-dimethyl-1,2-oxazol-4-yl)phenol
SMILESCc1noc(C)c1-c1ccc(O)cc1
InChIInChI=1S/C11H11NO2/c1-7-11(8(2)14-12-7)9-3-5-10(13)6-4-9/h3-6,13H,1-2H3
InChIKeyKETDAHHUUHZPRG-UHFFFAOYSA-N
MW189.21 g/mol
LogP2.66
Rot. Bonds1

About 4-(3,5-dimethyl-1,2-oxazol-4-yl)phenol

4-(3,5-dimethyl-1,2-oxazol-4-yl)phenol (PubChem CID 11651288) has the molecular formula C11H11NO2 and a molecular weight of 189.21 g/mol. Its IUPAC name is 4-(3,5-dimethyl-1,2-oxazol-4-yl)phenol.

Molecular Properties

Compound Name4-(3,5-dimethyl-1,2-oxazol-4-yl)phenol
PubChem CID11651288
Molecular FormulaC11H11NO2
Molecular Weight189.21 g/mol
Exact Mass189.08
IUPAC Name4-(3,5-dimethyl-1,2-oxazol-4-yl)phenol
SMILESCc1noc(C)c1-c1ccc(O)cc1
InChIInChI=1S/C11H11NO2/c1-7-11(8(2)14-12-7)9-3-5-10(13)6-4-9/h3-6,13H,1-2H3
InChIKeyKETDAHHUUHZPRG-UHFFFAOYSA-N
XLogP2.66
TPSA46.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.21
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(3,5-dimethyl-1,2-oxazol-4-yl)phenol?
The IUPAC name of 4-(3,5-dimethyl-1,2-oxazol-4-yl)phenol (CID 11651288) is 4-(3,5-dimethyl-1,2-oxazol-4-yl)phenol.
What is the SMILES notation for 4-(3,5-dimethyl-1,2-oxazol-4-yl)phenol?
The canonical SMILES for 4-(3,5-dimethyl-1,2-oxazol-4-yl)phenol is Cc1noc(C)c1-c1ccc(O)cc1.
What is the InChIKey of 4-(3,5-dimethyl-1,2-oxazol-4-yl)phenol?
The InChIKey is KETDAHHUUHZPRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO2/c1-7-11(8(2)14-12-7)9-3-5-10(13)6-4-9/h3-6,13H,1-2H3.
What are the key properties of 4-(3,5-dimethyl-1,2-oxazol-4-yl)phenol?
4-(3,5-dimethyl-1,2-oxazol-4-yl)phenol has a molecular weight of 189.21 g/mol, XLogP of 2.66, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,5-dimethyl-1,2-oxazol-4-yl)phenol is sourced from PubChem (CID 11651288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).