[4-[(5-ethyl-1,3,4-oxadiazol-2-yl)methoxy]-3-methoxyphenyl]methanol

C13H16N2O4 — CID 28782963

IUPAC[4-[(5-ethyl-1,3,4-oxadiazol-2-yl)methoxy]-3-methoxyphenyl]methanol
SMILESCCc1nnc(COc2ccc(CO)cc2OC)o1
InChIInChI=1S/C13H16N2O4/c1-3-12-14-15-13(19-12)8-18-10-5-4-9(7-16)6-11(10)17-2/h4-6,16H,3,7-8H2,1-2H3
InChIKeyDMFWJAIUVUDHFY-UHFFFAOYSA-N
MW264.28 g/mol
LogP1.71
Rot. Bonds6

About [4-[(5-ethyl-1,3,4-oxadiazol-2-yl)methoxy]-3-methoxyphenyl]methanol

[4-[(5-ethyl-1,3,4-oxadiazol-2-yl)methoxy]-3-methoxyphenyl]methanol (PubChem CID 28782963) has the molecular formula C13H16N2O4 and a molecular weight of 264.28 g/mol. Its IUPAC name is [4-[(5-ethyl-1,3,4-oxadiazol-2-yl)methoxy]-3-methoxyphenyl]methanol.

Molecular Properties

Compound Name[4-[(5-ethyl-1,3,4-oxadiazol-2-yl)methoxy]-3-methoxyphenyl]methanol
PubChem CID28782963
Molecular FormulaC13H16N2O4
Molecular Weight264.28 g/mol
Exact Mass264.11
IUPAC Name[4-[(5-ethyl-1,3,4-oxadiazol-2-yl)methoxy]-3-methoxyphenyl]methanol
SMILESCCc1nnc(COc2ccc(CO)cc2OC)o1
InChIInChI=1S/C13H16N2O4/c1-3-12-14-15-13(19-12)8-18-10-5-4-9(7-16)6-11(10)17-2/h4-6,16H,3,7-8H2,1-2H3
InChIKeyDMFWJAIUVUDHFY-UHFFFAOYSA-N
XLogP1.71
TPSA77.61 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.28
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze [4-[(5-ethyl-1,3,4-oxadiazol-2-yl)methoxy]-3-methoxyphenyl]methanol with MolForge

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Related Compounds

[3-methoxy-4-(pyridin-3-ylmethoxy)phenyl]methanol
CID 28562159
[4-[[4-(aminomethyl)phenyl]methoxy]-3-methoxyphenyl]methanol
CID 107742818
1-[3-methoxy-4-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]butan-2-amine
CID 60907255
[4-methoxy-3-(pyrimidin-2-ylmethoxy)phenyl]methanol
CID 62700689
[4-[(5-amino-1,3,4-thiadiazol-2-yl)methoxy]-3-methoxyphenyl]methanol
CID 107744788
[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-3-methoxyphenyl]methanol
CID 28782952
2-[(5-ethyl-1,3,4-oxadiazol-2-yl)methoxy]-4-methoxybenzoic acid
CID 61269411
[4-[[6-(ethylamino)-3-pyridinyl]methoxy]-3-methoxyphenyl]methanol
CID 107744742
[4-[(3-aminophenyl)methoxy]-3-methoxyphenyl]methanol
CID 107742663
[3-methoxy-4-[(1-methylpyrazol-4-yl)methoxy]phenyl]methanol
CID 28782967
[3-bromo-4-[(5-ethyl-1,3,4-oxadiazol-2-yl)methoxy]-5-methoxyphenyl]methanamine
CID 60888899
N-[[4-methoxy-3-[(5-methyl-1,3,4-oxadiazol-2-yl)methoxy]phenyl]methyl]propan-2-amine
CID 60880953

Frequently Asked Questions

What is the IUPAC name of [4-[(5-ethyl-1,3,4-oxadiazol-2-yl)methoxy]-3-methoxyphenyl]methanol?
The IUPAC name of [4-[(5-ethyl-1,3,4-oxadiazol-2-yl)methoxy]-3-methoxyphenyl]methanol (CID 28782963) is [4-[(5-ethyl-1,3,4-oxadiazol-2-yl)methoxy]-3-methoxyphenyl]methanol.
What is the SMILES notation for [4-[(5-ethyl-1,3,4-oxadiazol-2-yl)methoxy]-3-methoxyphenyl]methanol?
The canonical SMILES for [4-[(5-ethyl-1,3,4-oxadiazol-2-yl)methoxy]-3-methoxyphenyl]methanol is CCc1nnc(COc2ccc(CO)cc2OC)o1.
What is the InChIKey of [4-[(5-ethyl-1,3,4-oxadiazol-2-yl)methoxy]-3-methoxyphenyl]methanol?
The InChIKey is DMFWJAIUVUDHFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O4/c1-3-12-14-15-13(19-12)8-18-10-5-4-9(7-16)6-11(10)17-2/h4-6,16H,3,7-8H2,1-2H3.
What are the key properties of [4-[(5-ethyl-1,3,4-oxadiazol-2-yl)methoxy]-3-methoxyphenyl]methanol?
[4-[(5-ethyl-1,3,4-oxadiazol-2-yl)methoxy]-3-methoxyphenyl]methanol has a molecular weight of 264.28 g/mol, XLogP of 1.71, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(5-ethyl-1,3,4-oxadiazol-2-yl)methoxy]-3-methoxyphenyl]methanol is sourced from PubChem (CID 28782963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).