2-(furan-2-yl)-5-methyl-N-(oxolan-3-ylmethyl)-1,3-thiazole-4-carboxamide

C14H16N2O3S — CID 53498477

IUPAC2-(furan-2-yl)-5-methyl-N-(oxolan-3-ylmethyl)-1,3-thiazole-4-carboxamide
SMILESCc1sc(-c2ccco2)nc1C(=O)NCC1CCOC1
InChIInChI=1S/C14H16N2O3S/c1-9-12(13(17)15-7-10-4-6-18-8-10)16-14(20-9)11-3-2-5-19-11/h2-3,5,10H,4,6-8H2,1H3,(H,15,17)
InChIKeyGFKYUVKPOZYIQQ-UHFFFAOYSA-N
MW292.36 g/mol
LogP2.48
Rot. Bonds4

About 2-(furan-2-yl)-5-methyl-N-(oxolan-3-ylmethyl)-1,3-thiazole-4-carboxamide

2-(furan-2-yl)-5-methyl-N-(oxolan-3-ylmethyl)-1,3-thiazole-4-carboxamide (PubChem CID 53498477) has the molecular formula C14H16N2O3S and a molecular weight of 292.36 g/mol. Its IUPAC name is 2-(furan-2-yl)-5-methyl-N-(oxolan-3-ylmethyl)-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-(furan-2-yl)-5-methyl-N-(oxolan-3-ylmethyl)-1,3-thiazole-4-carboxamide
PubChem CID53498477
Molecular FormulaC14H16N2O3S
Molecular Weight292.36 g/mol
Exact Mass292.09
IUPAC Name2-(furan-2-yl)-5-methyl-N-(oxolan-3-ylmethyl)-1,3-thiazole-4-carboxamide
SMILESCc1sc(-c2ccco2)nc1C(=O)NCC1CCOC1
InChIInChI=1S/C14H16N2O3S/c1-9-12(13(17)15-7-10-4-6-18-8-10)16-14(20-9)11-3-2-5-19-11/h2-3,5,10H,4,6-8H2,1H3,(H,15,17)
InChIKeyGFKYUVKPOZYIQQ-UHFFFAOYSA-N
XLogP2.48
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.36
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-5-methyl-N-(oxolan-3-ylmethyl)-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-(furan-2-yl)-5-methyl-N-(oxolan-3-ylmethyl)-1,3-thiazole-4-carboxamide (CID 53498477) is 2-(furan-2-yl)-5-methyl-N-(oxolan-3-ylmethyl)-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-(furan-2-yl)-5-methyl-N-(oxolan-3-ylmethyl)-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-(furan-2-yl)-5-methyl-N-(oxolan-3-ylmethyl)-1,3-thiazole-4-carboxamide is Cc1sc(-c2ccco2)nc1C(=O)NCC1CCOC1.
What is the InChIKey of 2-(furan-2-yl)-5-methyl-N-(oxolan-3-ylmethyl)-1,3-thiazole-4-carboxamide?
The InChIKey is GFKYUVKPOZYIQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3S/c1-9-12(13(17)15-7-10-4-6-18-8-10)16-14(20-9)11-3-2-5-19-11/h2-3,5,10H,4,6-8H2,1H3,(H,15,17).
What are the key properties of 2-(furan-2-yl)-5-methyl-N-(oxolan-3-ylmethyl)-1,3-thiazole-4-carboxamide?
2-(furan-2-yl)-5-methyl-N-(oxolan-3-ylmethyl)-1,3-thiazole-4-carboxamide has a molecular weight of 292.36 g/mol, XLogP of 2.48, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-5-methyl-N-(oxolan-3-ylmethyl)-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 53498477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).