[3-ethoxy-5-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]phenyl]methanol

C20H21NO4 — CID 69427333

IUPAC[3-ethoxy-5-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]phenyl]methanol
SMILESCCOc1cc(CO)cc(OCc2nc(-c3ccccc3)oc2C)c1
InChIInChI=1S/C20H21NO4/c1-3-23-17-9-15(12-22)10-18(11-17)24-13-19-14(2)25-20(21-19)16-7-5-4-6-8-16/h4-11,22H,3,12-13H2,1-2H3
InChIKeySPVXEVGYFBIPBG-UHFFFAOYSA-N
MW339.39 g/mol
LogP4.12
Rot. Bonds7

About [3-ethoxy-5-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]phenyl]methanol

[3-ethoxy-5-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]phenyl]methanol (PubChem CID 69427333) has the molecular formula C20H21NO4 and a molecular weight of 339.39 g/mol. Its IUPAC name is [3-ethoxy-5-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]phenyl]methanol.

Molecular Properties

Compound Name[3-ethoxy-5-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]phenyl]methanol
PubChem CID69427333
Molecular FormulaC20H21NO4
Molecular Weight339.39 g/mol
Exact Mass339.15
IUPAC Name[3-ethoxy-5-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]phenyl]methanol
SMILESCCOc1cc(CO)cc(OCc2nc(-c3ccccc3)oc2C)c1
InChIInChI=1S/C20H21NO4/c1-3-23-17-9-15(12-22)10-18(11-17)24-13-19-14(2)25-20(21-19)16-7-5-4-6-8-16/h4-11,22H,3,12-13H2,1-2H3
InChIKeySPVXEVGYFBIPBG-UHFFFAOYSA-N
XLogP4.12
TPSA64.72 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.39
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[3-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]phenyl]methanol
CID 11140977
2-[5-ethoxy-2-[4-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]benzoyl]phenoxy]acetic acid
CID 68909292
2-[3-[[4-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]phenyl]methoxy]phenyl]acetic acid
CID 68883980
(E)-3-[6-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]-1-benzofuran-2-yl]prop-2-en-1-ol
CID 139705393
ethyl 3-[2-ethoxy-4-[[3-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]phenyl]methoxy]phenyl]propanoate
CID 68883694
2-[2-[[3-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]phenyl]methoxy]phenyl]acetic acid
CID 68884245
(1R)-1-[4-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]phenyl]ethanamine
CID 142052737
5-methyl-2-phenyl-4-[2-(3-propylphenoxy)ethyl]-1,3-oxazole
CID 23402836
methyl 3-[4-[[4-(hydroxymethyl)phenoxy]methyl]-5-methyl-1,3-oxazol-2-yl]benzoate
CID 23076400
ethyl 3-[5-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]-2-pyridinyl]propanoate
CID 141039508
ethyl (2E,4E)-5-[4-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]phenyl]penta-2,4-dienoate
CID 86750133
5-ethoxy-5-[4-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]phenyl]pentan-1-amine
CID 68882089

Frequently Asked Questions

What is the IUPAC name of [3-ethoxy-5-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]phenyl]methanol?
The IUPAC name of [3-ethoxy-5-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]phenyl]methanol (CID 69427333) is [3-ethoxy-5-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]phenyl]methanol.
What is the SMILES notation for [3-ethoxy-5-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]phenyl]methanol?
The canonical SMILES for [3-ethoxy-5-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]phenyl]methanol is CCOc1cc(CO)cc(OCc2nc(-c3ccccc3)oc2C)c1.
What is the InChIKey of [3-ethoxy-5-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]phenyl]methanol?
The InChIKey is SPVXEVGYFBIPBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21NO4/c1-3-23-17-9-15(12-22)10-18(11-17)24-13-19-14(2)25-20(21-19)16-7-5-4-6-8-16/h4-11,22H,3,12-13H2,1-2H3.
What are the key properties of [3-ethoxy-5-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]phenyl]methanol?
[3-ethoxy-5-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]phenyl]methanol has a molecular weight of 339.39 g/mol, XLogP of 4.12, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-ethoxy-5-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]phenyl]methanol is sourced from PubChem (CID 69427333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).