4-[(5R)-3-methyl-4,5-dihydro-1,2-oxazol-5-yl]phenol

C10H11NO2 — CID 143618145

IUPAC4-[(5R)-3-methyl-4,5-dihydro-1,2-oxazol-5-yl]phenol
SMILESCC1=NO[C@@H](c2ccc(O)cc2)C1
InChIInChI=1S/C10H11NO2/c1-7-6-10(13-11-7)8-2-4-9(12)5-3-8/h2-5,10,12H,6H2,1H3/t10-/m1/s1
InChIKeyMPQRJYYREWSEAM-SNVBAGLBSA-N
MW177.20 g/mol
LogP2.23
Rot. Bonds1

About 4-[(5R)-3-methyl-4,5-dihydro-1,2-oxazol-5-yl]phenol

4-[(5R)-3-methyl-4,5-dihydro-1,2-oxazol-5-yl]phenol (PubChem CID 143618145) has the molecular formula C10H11NO2 and a molecular weight of 177.20 g/mol. Its IUPAC name is 4-[(5R)-3-methyl-4,5-dihydro-1,2-oxazol-5-yl]phenol.

Molecular Properties

Compound Name4-[(5R)-3-methyl-4,5-dihydro-1,2-oxazol-5-yl]phenol
PubChem CID143618145
Molecular FormulaC10H11NO2
Molecular Weight177.20 g/mol
Exact Mass177.08
IUPAC Name4-[(5R)-3-methyl-4,5-dihydro-1,2-oxazol-5-yl]phenol
SMILESCC1=NO[C@@H](c2ccc(O)cc2)C1
InChIInChI=1S/C10H11NO2/c1-7-6-10(13-11-7)8-2-4-9(12)5-3-8/h2-5,10,12H,6H2,1H3/t10-/m1/s1
InChIKeyMPQRJYYREWSEAM-SNVBAGLBSA-N
XLogP2.23
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.20
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-methoxy-5-(4-methylphenyl)-4,5-dihydro-1,2-oxazole
CID 89241299
4-[(5R)-3-(N-ethylanilino)-4,5-dihydro-1,2-oxazol-5-yl]phenol
CID 88979546
5-(2-isocyanophenyl)-3-methyl-4,5-dihydro-1,2-oxazole
CID 58433161
5-fluoro-3-methyl-4,5-dihydro-1,2-oxazole
CID 90455407
4-[(5S)-3-bromo-4,5-dihydro-1,2-oxazol-5-yl]-N,N-dimethylbenzamide;4-[(5R)-3-bromo-4,5-dihydro-1,2-oxazol-5-yl]-N,N-dimethylbenzamide
CID 158523651
(5S)-3-bromo-5-phenyl-4,5-dihydro-1,2-oxazole;(5R)-3-bromo-5-phenyl-4,5-dihydro-1,2-oxazole
CID 159139120
(2S)-2-ethoxy-3-[3-[5-(4-hydroxyphenyl)-4,5-dihydro-1,2-oxazol-3-yl]phenyl]propanoic acid
CID 25116251
4-[3-(4-hydroxyphenyl)-5-methyl-4,5-dihydro-1,2-oxazol-4-yl]phenol
CID 137099163
[5-(4-methoxyphenyl)-4,5-dihydro-1,2-oxazol-3-yl]methanamine
CID 105458829
ethane;3-methyl-4,5-dihydro-1,2-oxazol-5-ol
CID 143101190
4-(2-methylidenecyclopropyl)phenol
CID 163485909
3-bromo-5-[4-(6-methylpyridazin-3-yl)oxyphenyl]-4,5-dihydro-1,2-oxazole
CID 58126420

Frequently Asked Questions

What is the IUPAC name of 4-[(5R)-3-methyl-4,5-dihydro-1,2-oxazol-5-yl]phenol?
The IUPAC name of 4-[(5R)-3-methyl-4,5-dihydro-1,2-oxazol-5-yl]phenol (CID 143618145) is 4-[(5R)-3-methyl-4,5-dihydro-1,2-oxazol-5-yl]phenol.
What is the SMILES notation for 4-[(5R)-3-methyl-4,5-dihydro-1,2-oxazol-5-yl]phenol?
The canonical SMILES for 4-[(5R)-3-methyl-4,5-dihydro-1,2-oxazol-5-yl]phenol is CC1=NO[C@@H](c2ccc(O)cc2)C1.
What is the InChIKey of 4-[(5R)-3-methyl-4,5-dihydro-1,2-oxazol-5-yl]phenol?
The InChIKey is MPQRJYYREWSEAM-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H11NO2/c1-7-6-10(13-11-7)8-2-4-9(12)5-3-8/h2-5,10,12H,6H2,1H3/t10-/m1/s1.
What are the key properties of 4-[(5R)-3-methyl-4,5-dihydro-1,2-oxazol-5-yl]phenol?
4-[(5R)-3-methyl-4,5-dihydro-1,2-oxazol-5-yl]phenol has a molecular weight of 177.20 g/mol, XLogP of 2.23, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(5R)-3-methyl-4,5-dihydro-1,2-oxazol-5-yl]phenol is sourced from PubChem (CID 143618145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).