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

C13H14N2O3S — CID 53498385

IUPAC2-(furan-2-yl)-N-(oxolan-3-ylmethyl)-1,3-thiazole-4-carboxamide
SMILESO=C(NCC1CCOC1)c1csc(-c2ccco2)n1
InChIInChI=1S/C13H14N2O3S/c16-12(14-6-9-3-5-17-7-9)10-8-19-13(15-10)11-2-1-4-18-11/h1-2,4,8-9H,3,5-7H2,(H,14,16)
InChIKeyQIWUZRFEUFUVBO-UHFFFAOYSA-N
MW278.33 g/mol
LogP2.17
Rot. Bonds4

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

2-(furan-2-yl)-N-(oxolan-3-ylmethyl)-1,3-thiazole-4-carboxamide (PubChem CID 53498385) has the molecular formula C13H14N2O3S and a molecular weight of 278.33 g/mol. Its IUPAC name is 2-(furan-2-yl)-N-(oxolan-3-ylmethyl)-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-(furan-2-yl)-N-(oxolan-3-ylmethyl)-1,3-thiazole-4-carboxamide
PubChem CID53498385
Molecular FormulaC13H14N2O3S
Molecular Weight278.33 g/mol
Exact Mass278.07
IUPAC Name2-(furan-2-yl)-N-(oxolan-3-ylmethyl)-1,3-thiazole-4-carboxamide
SMILESO=C(NCC1CCOC1)c1csc(-c2ccco2)n1
InChIInChI=1S/C13H14N2O3S/c16-12(14-6-9-3-5-17-7-9)10-8-19-13(15-10)11-2-1-4-18-11/h1-2,4,8-9H,3,5-7H2,(H,14,16)
InChIKeyQIWUZRFEUFUVBO-UHFFFAOYSA-N
XLogP2.17
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.33
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(furan-2-ylmethyl)-2-(2-phenyl-1,3-thiazol-4-yl)acetamide
CID 2567479
N-[[2-(3-methylphenyl)-1,3-thiazol-4-yl]methyl]furan-2-carboxamide
CID 6464408
N-[[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl]furan-2-carboxamide
CID 6468644
N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]furan-2-carboxamide
CID 7119107
N-{2-[2-(3-Fluorophenyl)-1,3-thiazol-4-YL]ethyl}furan-2-carboxamide
CID 7518526
3-methyl-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]furan-2-carboxamide
CID 123759102
2-(2,3-dihydro-1,4-benzodioxin-2-yl)-N-(furan-2-ylmethyl)-1,3-thiazole-4-carboxamide
CID 2821636
N-[(2-phenyl-1,3-thiazol-4-yl)methyl]furan-2-carboxamide
CID 2997523
N-(2-(2-(4-fluorophenyl)thiazol-4-yl)ethyl)furan-2-carboxamide
CID 7522069
N-[2-(4-phenyl-1,3-thiazol-2-yl)ethyl]furan-2-carboxamide
CID 54773765
CID 75364199
CID 75364199
N-(2-furylmethyl)-2-[(4-phenyl-1,3-thiazol-2-yl)thio]acetamide
CID 1263321

Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-N-(oxolan-3-ylmethyl)-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-(furan-2-yl)-N-(oxolan-3-ylmethyl)-1,3-thiazole-4-carboxamide (CID 53498385) is 2-(furan-2-yl)-N-(oxolan-3-ylmethyl)-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-(furan-2-yl)-N-(oxolan-3-ylmethyl)-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-(furan-2-yl)-N-(oxolan-3-ylmethyl)-1,3-thiazole-4-carboxamide is O=C(NCC1CCOC1)c1csc(-c2ccco2)n1.
What is the InChIKey of 2-(furan-2-yl)-N-(oxolan-3-ylmethyl)-1,3-thiazole-4-carboxamide?
The InChIKey is QIWUZRFEUFUVBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O3S/c16-12(14-6-9-3-5-17-7-9)10-8-19-13(15-10)11-2-1-4-18-11/h1-2,4,8-9H,3,5-7H2,(H,14,16).
What are the key properties of 2-(furan-2-yl)-N-(oxolan-3-ylmethyl)-1,3-thiazole-4-carboxamide?
2-(furan-2-yl)-N-(oxolan-3-ylmethyl)-1,3-thiazole-4-carboxamide has a molecular weight of 278.33 g/mol, XLogP of 2.17, 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)-N-(oxolan-3-ylmethyl)-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 53498385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).