2-[2-(3-hydroxypropyl)-1,3-oxazol-4-yl]phenol

C12H13NO3 — CID 115031212

IUPAC2-[2-(3-hydroxypropyl)-1,3-oxazol-4-yl]phenol
SMILESOCCCc1nc(-c2ccccc2O)co1
InChIInChI=1S/C12H13NO3/c14-7-3-6-12-13-10(8-16-12)9-4-1-2-5-11(9)15/h1-2,4-5,8,14-15H,3,6-7H2
InChIKeyOBTZADDBHQKUEB-UHFFFAOYSA-N
MW219.24 g/mol
LogP1.97
Rot. Bonds4

About 2-[2-(3-hydroxypropyl)-1,3-oxazol-4-yl]phenol

2-[2-(3-hydroxypropyl)-1,3-oxazol-4-yl]phenol (PubChem CID 115031212) has the molecular formula C12H13NO3 and a molecular weight of 219.24 g/mol. Its IUPAC name is 2-[2-(3-hydroxypropyl)-1,3-oxazol-4-yl]phenol.

Molecular Properties

Compound Name2-[2-(3-hydroxypropyl)-1,3-oxazol-4-yl]phenol
PubChem CID115031212
Molecular FormulaC12H13NO3
Molecular Weight219.24 g/mol
Exact Mass219.09
IUPAC Name2-[2-(3-hydroxypropyl)-1,3-oxazol-4-yl]phenol
SMILESOCCCc1nc(-c2ccccc2O)co1
InChIInChI=1S/C12H13NO3/c14-7-3-6-12-13-10(8-16-12)9-4-1-2-5-11(9)15/h1-2,4-5,8,14-15H,3,6-7H2
InChIKeyOBTZADDBHQKUEB-UHFFFAOYSA-N
XLogP1.97
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.24
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[2-(3-hydroxypropyl)-1,3-oxazol-4-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

3-[4-(2-bromophenyl)-1,3-oxazol-2-yl]propan-1-ol
CID 115051821
3-[2-(3-hydroxypropyl)-1,3-oxazol-4-yl]phenol
CID 115031213
2-(2-chloro-1,3-oxazol-4-yl)phenol
CID 105449568
3-(4-cyclopentyl-1,3-oxazol-2-yl)propan-1-ol
CID 115020265
2-[4-(2-methoxyphenyl)-1,3-oxazol-2-yl]ethanamine
CID 82285403
2-pentyl-4-pyridin-2-yl-1,3-oxazole
CID 69401080
3-[2-(3-hydroxypropyl)-1,3-oxazol-4-yl]propanoic acid
CID 115081944
3-[4-(1-aminopropan-2-yl)-1,3-oxazol-2-yl]propan-1-ol
CID 115081917
3-[4-(thian-2-yl)-1,3-oxazol-2-yl]propan-1-ol
CID 115036295
2-[3-[3-[4-[2-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]propoxy]phenyl]acetic acid
CID 90913403
3-[4-(1,1-dioxothiolan-3-yl)-1,3-oxazol-2-yl]propan-1-ol
CID 115045574
2-chloro-4-fluoro-5-(2-propyl-1,3-oxazol-4-yl)phenol
CID 165348424

Frequently Asked Questions

What is the IUPAC name of 2-[2-(3-hydroxypropyl)-1,3-oxazol-4-yl]phenol?
The IUPAC name of 2-[2-(3-hydroxypropyl)-1,3-oxazol-4-yl]phenol (CID 115031212) is 2-[2-(3-hydroxypropyl)-1,3-oxazol-4-yl]phenol.
What is the SMILES notation for 2-[2-(3-hydroxypropyl)-1,3-oxazol-4-yl]phenol?
The canonical SMILES for 2-[2-(3-hydroxypropyl)-1,3-oxazol-4-yl]phenol is OCCCc1nc(-c2ccccc2O)co1.
What is the InChIKey of 2-[2-(3-hydroxypropyl)-1,3-oxazol-4-yl]phenol?
The InChIKey is OBTZADDBHQKUEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO3/c14-7-3-6-12-13-10(8-16-12)9-4-1-2-5-11(9)15/h1-2,4-5,8,14-15H,3,6-7H2.
What are the key properties of 2-[2-(3-hydroxypropyl)-1,3-oxazol-4-yl]phenol?
2-[2-(3-hydroxypropyl)-1,3-oxazol-4-yl]phenol has a molecular weight of 219.24 g/mol, XLogP of 1.97, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3-hydroxypropyl)-1,3-oxazol-4-yl]phenol is sourced from PubChem (CID 115031212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).