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

C10H10N2O3 — CID 3041371

IUPAC[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]methanol
SMILESCOc1ccc(-c2nnc(CO)o2)cc1
InChIInChI=1S/C10H10N2O3/c1-14-8-4-2-7(3-5-8)10-12-11-9(6-13)15-10/h2-5,13H,6H2,1H3
InChIKeyNYWFODASCTYGIQ-UHFFFAOYSA-N
MW206.20 g/mol
LogP1.24
Rot. Bonds3

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

[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]methanol (PubChem CID 3041371) has the molecular formula C10H10N2O3 and a molecular weight of 206.20 g/mol. Its IUPAC name is [5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]methanol.

Molecular Properties

Compound Name[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]methanol
PubChem CID3041371
Molecular FormulaC10H10N2O3
Molecular Weight206.20 g/mol
Exact Mass206.07
IUPAC Name[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]methanol
SMILESCOc1ccc(-c2nnc(CO)o2)cc1
InChIInChI=1S/C10H10N2O3/c1-14-8-4-2-7(3-5-8)10-12-11-9(6-13)15-10/h2-5,13H,6H2,1H3
InChIKeyNYWFODASCTYGIQ-UHFFFAOYSA-N
XLogP1.24
TPSA68.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.20
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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

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Related Compounds

2-(methoxymethyl)-5-(4-methoxyphenyl)-1,3,4-oxadiazole
CID 67274190
2-(2-chloroethyl)-5-(4-methoxyphenyl)-1,3,4-oxadiazole
CID 43513285
2-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]-N-methylethanamine
CID 55044345
2-[3,5-bis[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]phenyl]-5-(4-methoxyphenyl)-1,3,4-oxadiazole
CID 638609
4-[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]methoxy]benzamide
CID 26051370
2-[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]methyl-prop-2-enylamino]ethanol
CID 111423799
[4-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]phenyl] acetate
CID 144750250
N-[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]methyl]-1-pyridin-4-ylmethanamine
CID 110652939
2-[(2-ethoxyphenoxy)methyl]-5-(4-methoxyphenyl)-1,3,4-oxadiazole
CID 110655871
2-(4-chlorophenyl)-5-[[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]-1,3,4-oxadiazole
CID 27920170
2-(4-methoxyphenyl)-5-[(3-methoxyphenyl)sulfanylmethyl]-1,3,4-oxadiazole
CID 35042305
2-(4-methoxyphenyl)-5-(thiomorpholin-4-ylmethyl)-1,3,4-oxadiazole
CID 5146548

Frequently Asked Questions

What is the IUPAC name of [5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]methanol?
The IUPAC name of [5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]methanol (CID 3041371) is [5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]methanol.
What is the SMILES notation for [5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]methanol?
The canonical SMILES for [5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]methanol is COc1ccc(-c2nnc(CO)o2)cc1.
What is the InChIKey of [5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]methanol?
The InChIKey is NYWFODASCTYGIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O3/c1-14-8-4-2-7(3-5-8)10-12-11-9(6-13)15-10/h2-5,13H,6H2,1H3.
What are the key properties of [5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]methanol?
[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]methanol has a molecular weight of 206.20 g/mol, XLogP of 1.24, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]methanol is sourced from PubChem (CID 3041371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).