N-(5-methyl-1,3,4-thiadiazol-2-yl)furan-2-carboxamide

C8H7N3O2S — CID 672518

IUPACN-(5-methyl-1,3,4-thiadiazol-2-yl)furan-2-carboxamide
SMILESCc1nnc(NC(=O)c2ccco2)s1
InChIInChI=1S/C8H7N3O2S/c1-5-10-11-8(14-5)9-7(12)6-3-2-4-13-6/h2-4H,1H3,(H,9,11,12)
InChIKeyZAVXDLFAONKFFV-UHFFFAOYSA-N
MW209.23 g/mol
LogP1.69
Rot. Bonds2

About N-(5-methyl-1,3,4-thiadiazol-2-yl)furan-2-carboxamide

N-(5-methyl-1,3,4-thiadiazol-2-yl)furan-2-carboxamide (PubChem CID 672518) has the molecular formula C8H7N3O2S and a molecular weight of 209.23 g/mol. Its IUPAC name is N-(5-methyl-1,3,4-thiadiazol-2-yl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(5-methyl-1,3,4-thiadiazol-2-yl)furan-2-carboxamide
PubChem CID672518
Molecular FormulaC8H7N3O2S
Molecular Weight209.23 g/mol
Exact Mass209.03
IUPAC NameN-(5-methyl-1,3,4-thiadiazol-2-yl)furan-2-carboxamide
SMILESCc1nnc(NC(=O)c2ccco2)s1
InChIInChI=1S/C8H7N3O2S/c1-5-10-11-8(14-5)9-7(12)6-3-2-4-13-6/h2-4H,1H3,(H,9,11,12)
InChIKeyZAVXDLFAONKFFV-UHFFFAOYSA-N
XLogP1.69
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.23
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-1,3,4-thiadiazol-2-yl)furan-2-carboxamide?
The IUPAC name of N-(5-methyl-1,3,4-thiadiazol-2-yl)furan-2-carboxamide (CID 672518) is N-(5-methyl-1,3,4-thiadiazol-2-yl)furan-2-carboxamide.
What is the SMILES notation for N-(5-methyl-1,3,4-thiadiazol-2-yl)furan-2-carboxamide?
The canonical SMILES for N-(5-methyl-1,3,4-thiadiazol-2-yl)furan-2-carboxamide is Cc1nnc(NC(=O)c2ccco2)s1.
What is the InChIKey of N-(5-methyl-1,3,4-thiadiazol-2-yl)furan-2-carboxamide?
The InChIKey is ZAVXDLFAONKFFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N3O2S/c1-5-10-11-8(14-5)9-7(12)6-3-2-4-13-6/h2-4H,1H3,(H,9,11,12).
What are the key properties of N-(5-methyl-1,3,4-thiadiazol-2-yl)furan-2-carboxamide?
N-(5-methyl-1,3,4-thiadiazol-2-yl)furan-2-carboxamide has a molecular weight of 209.23 g/mol, XLogP of 1.69, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-1,3,4-thiadiazol-2-yl)furan-2-carboxamide is sourced from PubChem (CID 672518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).