(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methanol

C7H6N2O2S — CID 43558918

IUPAC(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methanol
SMILESOCc1nnc(-c2cccs2)o1
InChIInChI=1S/C7H6N2O2S/c10-4-6-8-9-7(11-6)5-2-1-3-12-5/h1-3,10H,4H2
InChIKeyGDCRJCZPPYVPKZ-UHFFFAOYSA-N
MW182.20 g/mol
LogP1.29
Rot. Bonds2

About (5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methanol

(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methanol (PubChem CID 43558918) has the molecular formula C7H6N2O2S and a molecular weight of 182.20 g/mol. Its IUPAC name is (5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methanol.

Molecular Properties

Compound Name(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methanol
PubChem CID43558918
Molecular FormulaC7H6N2O2S
Molecular Weight182.20 g/mol
Exact Mass182.01
IUPAC Name(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methanol
SMILESOCc1nnc(-c2cccs2)o1
InChIInChI=1S/C7H6N2O2S/c10-4-6-8-9-7(11-6)5-2-1-3-12-5/h1-3,10H,4H2
InChIKeyGDCRJCZPPYVPKZ-UHFFFAOYSA-N
XLogP1.29
TPSA59.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.20
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(methoxymethyl)-5-thiophen-2-yl-1,3,4-oxadiazole
CID 53017470
3-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methylsulfanyl]propan-1-ol
CID 66126795
5-thiophen-2-yl-1,3,4-oxadiazol-2-amine
CID 16767328
N-(thiophen-2-ylmethyl)-2-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)acetamide
CID 53161971
N-[2-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)ethyl]thiophene-2-carboxamide
CID 110322424
2-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methylsulfanyl]pyrimidine-4,6-diamine
CID 4786816
ethane;2-methyl-5-thiophen-2-yl-1,3,4-oxadiazole
CID 143800921
5-thiophen-2-yl-1,3,4-oxadiazol-2-olate
CID 51401385
N-methyl-1-thiophen-2-yl-N-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]ethanamine
CID 78827467
1-phenyl-3-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]urea
CID 110322316
2-amino-3-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methylsulfanyl]propanoic acid
CID 43385486
2-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methylsulfanyl]benzoic acid
CID 43092573

Frequently Asked Questions

What is the IUPAC name of (5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methanol?
The IUPAC name of (5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methanol (CID 43558918) is (5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methanol.
What is the SMILES notation for (5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methanol?
The canonical SMILES for (5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methanol is OCc1nnc(-c2cccs2)o1.
What is the InChIKey of (5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methanol?
The InChIKey is GDCRJCZPPYVPKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N2O2S/c10-4-6-8-9-7(11-6)5-2-1-3-12-5/h1-3,10H,4H2.
What are the key properties of (5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methanol?
(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methanol has a molecular weight of 182.20 g/mol, XLogP of 1.29, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methanol is sourced from PubChem (CID 43558918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).