[2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)phenyl]-phenylmethanol

C18H19NO2 — CID 12856165

IUPAC[2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)phenyl]-phenylmethanol
SMILESCC1(C)COC(c2ccccc2C(O)c2ccccc2)=N1
InChIInChI=1S/C18H19NO2/c1-18(2)12-21-17(19-18)15-11-7-6-10-14(15)16(20)13-8-4-3-5-9-13/h3-11,16,20H,12H2,1-2H3
InChIKeyWUMZTMCQTLMAKT-UHFFFAOYSA-N
MW281.36 g/mol
LogP3.32
Rot. Bonds3

About [2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)phenyl]-phenylmethanol

[2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)phenyl]-phenylmethanol (PubChem CID 12856165) has the molecular formula C18H19NO2 and a molecular weight of 281.36 g/mol. Its IUPAC name is [2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)phenyl]-phenylmethanol.

Molecular Properties

Compound Name[2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)phenyl]-phenylmethanol
PubChem CID12856165
Molecular FormulaC18H19NO2
Molecular Weight281.36 g/mol
Exact Mass281.14
IUPAC Name[2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)phenyl]-phenylmethanol
SMILESCC1(C)COC(c2ccccc2C(O)c2ccccc2)=N1
InChIInChI=1S/C18H19NO2/c1-18(2)12-21-17(19-18)15-11-7-6-10-14(15)16(20)13-8-4-3-5-9-13/h3-11,16,20H,12H2,1-2H3
InChIKeyWUMZTMCQTLMAKT-UHFFFAOYSA-N
XLogP3.32
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-Methyl-2-phenyl-4,5-dihydro-1,3-oxazol-4-yl)methanol
CID 226853
4,4-Dimethyl-2-(4'-methyl-2-biphenylyl)-2-oxazoline
CID 688301
(4-Chloro-phenyl)-[4-(4,4-dimethyl-4,5-dihydro-oxazol-2-yl)-phenyl]-methanol
CID 44354147
Txnhzxwelnuonz-uhfffaoysa-
CID 2732888
2-([1,1'-Biphenyl]-2-yl)-4,4-dimethyl-4,5-dihydrooxazole
CID 395641
Benzyl alcohol, o-(alpha-(2-(dimethylamino)ethoxy)benzyl)-
CID 33349
((4S,5S)-2-Biphenyl-4-yl-5-vinyl-4,5-dihydro-oxazol-4-yl)-methanol
CID 44394838
4,4-Dimethyl-2-(2-methylphenyl)-4,5-dihydro-1,3-oxazole
CID 10487889
4,4-dimethyl-2-[2-methyl-6-[(E)-2-phenylethenyl]phenyl]-5H-1,3-oxazole
CID 23584346
5-(Fluoromethyl)-2-(2-phenylphenyl)-4,5-dihydro-1,3-oxazole
CID 178252037
(R)-phenyl-[(4S)-2-phenyl-4,5-dihydro-1,3-oxazol-4-yl]methanol
CID 12034624
[2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-3-phenylphenyl]-trimethylsilane
CID 13439172

Frequently Asked Questions

What is the IUPAC name of [2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)phenyl]-phenylmethanol?
The IUPAC name of [2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)phenyl]-phenylmethanol (CID 12856165) is [2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)phenyl]-phenylmethanol.
What is the SMILES notation for [2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)phenyl]-phenylmethanol?
The canonical SMILES for [2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)phenyl]-phenylmethanol is CC1(C)COC(c2ccccc2C(O)c2ccccc2)=N1.
What is the InChIKey of [2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)phenyl]-phenylmethanol?
The InChIKey is WUMZTMCQTLMAKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO2/c1-18(2)12-21-17(19-18)15-11-7-6-10-14(15)16(20)13-8-4-3-5-9-13/h3-11,16,20H,12H2,1-2H3.
What are the key properties of [2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)phenyl]-phenylmethanol?
[2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)phenyl]-phenylmethanol has a molecular weight of 281.36 g/mol, XLogP of 3.32, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)phenyl]-phenylmethanol is sourced from PubChem (CID 12856165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).