2-methylfuro[3,2-d][1,3]thiazole

C6H5NOS — CID 140729886

IUPAC2-methylfuro[3,2-d][1,3]thiazole
SMILESCc1nc2ccoc2s1
InChIInChI=1S/C6H5NOS/c1-4-7-5-2-3-8-6(5)9-4/h2-3H,1H3
InChIKeyVFIFQSQICAUZRM-UHFFFAOYSA-N
MW139.18 g/mol
LogP2.20
Rot. Bonds

About 2-methylfuro[3,2-d][1,3]thiazole

2-methylfuro[3,2-d][1,3]thiazole (PubChem CID 140729886) has the molecular formula C6H5NOS and a molecular weight of 139.18 g/mol. Its IUPAC name is 2-methylfuro[3,2-d][1,3]thiazole.

Molecular Properties

Compound Name2-methylfuro[3,2-d][1,3]thiazole
PubChem CID140729886
Molecular FormulaC6H5NOS
Molecular Weight139.18 g/mol
Exact Mass139.01
IUPAC Name2-methylfuro[3,2-d][1,3]thiazole
SMILESCc1nc2ccoc2s1
InChIInChI=1S/C6H5NOS/c1-4-7-5-2-3-8-6(5)9-4/h2-3H,1H3
InChIKeyVFIFQSQICAUZRM-UHFFFAOYSA-N
XLogP2.20
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.18
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methylfuro[3,2-d][1,3]thiazole?
The IUPAC name of 2-methylfuro[3,2-d][1,3]thiazole (CID 140729886) is 2-methylfuro[3,2-d][1,3]thiazole.
What is the SMILES notation for 2-methylfuro[3,2-d][1,3]thiazole?
The canonical SMILES for 2-methylfuro[3,2-d][1,3]thiazole is Cc1nc2ccoc2s1.
What is the InChIKey of 2-methylfuro[3,2-d][1,3]thiazole?
The InChIKey is VFIFQSQICAUZRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5NOS/c1-4-7-5-2-3-8-6(5)9-4/h2-3H,1H3.
What are the key properties of 2-methylfuro[3,2-d][1,3]thiazole?
2-methylfuro[3,2-d][1,3]thiazole has a molecular weight of 139.18 g/mol, XLogP of 2.20, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylfuro[3,2-d][1,3]thiazole is sourced from PubChem (CID 140729886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).