2-methyl-N-(1,3-thiazol-2-yl)furan-3-carboxamide

C9H8N2O2S — CID 874518

IUPAC2-methyl-N-(1,3-thiazol-2-yl)furan-3-carboxamide
SMILESCc1occc1C(=O)Nc1nccs1
InChIInChI=1S/C9H8N2O2S/c1-6-7(2-4-13-6)8(12)11-9-10-3-5-14-9/h2-5H,1H3,(H,10,11,12)
InChIKeyXSXADIVCRLCMQH-UHFFFAOYSA-N
MW208.24 g/mol
LogP2.30
Rot. Bonds2

About 2-methyl-N-(1,3-thiazol-2-yl)furan-3-carboxamide

2-methyl-N-(1,3-thiazol-2-yl)furan-3-carboxamide (PubChem CID 874518) has the molecular formula C9H8N2O2S and a molecular weight of 208.24 g/mol. Its IUPAC name is 2-methyl-N-(1,3-thiazol-2-yl)furan-3-carboxamide.

Molecular Properties

Compound Name2-methyl-N-(1,3-thiazol-2-yl)furan-3-carboxamide
PubChem CID874518
Molecular FormulaC9H8N2O2S
Molecular Weight208.24 g/mol
Exact Mass208.03
IUPAC Name2-methyl-N-(1,3-thiazol-2-yl)furan-3-carboxamide
SMILESCc1occc1C(=O)Nc1nccs1
InChIInChI=1S/C9H8N2O2S/c1-6-7(2-4-13-6)8(12)11-9-10-3-5-14-9/h2-5H,1H3,(H,10,11,12)
InChIKeyXSXADIVCRLCMQH-UHFFFAOYSA-N
XLogP2.30
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.24
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(1,3-thiazol-2-yl)furan-3-carboxamide?
The IUPAC name of 2-methyl-N-(1,3-thiazol-2-yl)furan-3-carboxamide (CID 874518) is 2-methyl-N-(1,3-thiazol-2-yl)furan-3-carboxamide.
What is the SMILES notation for 2-methyl-N-(1,3-thiazol-2-yl)furan-3-carboxamide?
The canonical SMILES for 2-methyl-N-(1,3-thiazol-2-yl)furan-3-carboxamide is Cc1occc1C(=O)Nc1nccs1.
What is the InChIKey of 2-methyl-N-(1,3-thiazol-2-yl)furan-3-carboxamide?
The InChIKey is XSXADIVCRLCMQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2O2S/c1-6-7(2-4-13-6)8(12)11-9-10-3-5-14-9/h2-5H,1H3,(H,10,11,12).
What are the key properties of 2-methyl-N-(1,3-thiazol-2-yl)furan-3-carboxamide?
2-methyl-N-(1,3-thiazol-2-yl)furan-3-carboxamide has a molecular weight of 208.24 g/mol, XLogP of 2.30, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(1,3-thiazol-2-yl)furan-3-carboxamide is sourced from PubChem (CID 874518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).