2-(furan-2-yl)-5-methyl-N-(4-methyl-1H-pyrazol-5-yl)-1,3-thiazole-4-carboxamide

C13H12N4O2S — CID 115630153

IUPAC2-(furan-2-yl)-5-methyl-N-(4-methyl-1H-pyrazol-5-yl)-1,3-thiazole-4-carboxamide
SMILESCc1cn[nH]c1NC(=O)c1nc(-c2ccco2)sc1C
InChIInChI=1S/C13H12N4O2S/c1-7-6-14-17-11(7)16-12(18)10-8(2)20-13(15-10)9-4-3-5-19-9/h3-6H,1-2H3,(H2,14,16,17,18)
InChIKeyYIYJXHKJTRXSRI-UHFFFAOYSA-N
MW288.33 g/mol
LogP3.00
Rot. Bonds3

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

2-(furan-2-yl)-5-methyl-N-(4-methyl-1H-pyrazol-5-yl)-1,3-thiazole-4-carboxamide (PubChem CID 115630153) has the molecular formula C13H12N4O2S and a molecular weight of 288.33 g/mol. Its IUPAC name is 2-(furan-2-yl)-5-methyl-N-(4-methyl-1H-pyrazol-5-yl)-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-(furan-2-yl)-5-methyl-N-(4-methyl-1H-pyrazol-5-yl)-1,3-thiazole-4-carboxamide
PubChem CID115630153
Molecular FormulaC13H12N4O2S
Molecular Weight288.33 g/mol
Exact Mass288.07
IUPAC Name2-(furan-2-yl)-5-methyl-N-(4-methyl-1H-pyrazol-5-yl)-1,3-thiazole-4-carboxamide
SMILESCc1cn[nH]c1NC(=O)c1nc(-c2ccco2)sc1C
InChIInChI=1S/C13H12N4O2S/c1-7-6-14-17-11(7)16-12(18)10-8(2)20-13(15-10)9-4-3-5-19-9/h3-6H,1-2H3,(H2,14,16,17,18)
InChIKeyYIYJXHKJTRXSRI-UHFFFAOYSA-N
XLogP3.00
TPSA83.81 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.33
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(furan-2-yl)-5-methyl-1,3-thiazole-4-carbohydrazide
CID 43244788
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CID 83090312
2-(furan-2-yl)-N-(2-hydroxy-4-methylphenyl)-5-methyl-1,3-thiazole-4-carboxamide
CID 134018768
2-(furan-2-yl)-N-(2-methoxyethoxy)-5-methyl-1,3-thiazole-4-carboxamide
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2-(furan-2-yl)-5-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]-1,3-thiazole-4-carboxamide
CID 55834234
2-(furan-2-yl)-N-(1-hydroxypentan-3-yl)-5-methyl-1,3-thiazole-4-carboxamide
CID 115735226
2-(furan-2-yl)-5-methyl-N-[4-(propylcarbamoyl)phenyl]-1,3-thiazole-4-carboxamide
CID 55893940
N-(3-amino-2-methylpropyl)-2-(furan-2-yl)-5-methyl-1,3-thiazole-4-carboxamide
CID 119997754
2-(furan-2-yl)-5-methyl-N'-(pyridine-2-carbonyl)-1,3-thiazole-4-carbohydrazide
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2-(furan-2-yl)-5-methyl-N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)-1,3-thiazole-4-carboxamide
CID 43051598
2-(furan-2-yl)-N-(4-hydroxypentyl)-5-methyl-1,3-thiazole-4-carboxamide
CID 107299887
2-(furan-2-yl)-5-methyl-N-[(3-methyloxetan-3-yl)methyl]-1,3-thiazole-4-carboxamide
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Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-5-methyl-N-(4-methyl-1H-pyrazol-5-yl)-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-(furan-2-yl)-5-methyl-N-(4-methyl-1H-pyrazol-5-yl)-1,3-thiazole-4-carboxamide (CID 115630153) is 2-(furan-2-yl)-5-methyl-N-(4-methyl-1H-pyrazol-5-yl)-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-(furan-2-yl)-5-methyl-N-(4-methyl-1H-pyrazol-5-yl)-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-(furan-2-yl)-5-methyl-N-(4-methyl-1H-pyrazol-5-yl)-1,3-thiazole-4-carboxamide is Cc1cn[nH]c1NC(=O)c1nc(-c2ccco2)sc1C.
What is the InChIKey of 2-(furan-2-yl)-5-methyl-N-(4-methyl-1H-pyrazol-5-yl)-1,3-thiazole-4-carboxamide?
The InChIKey is YIYJXHKJTRXSRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N4O2S/c1-7-6-14-17-11(7)16-12(18)10-8(2)20-13(15-10)9-4-3-5-19-9/h3-6H,1-2H3,(H2,14,16,17,18).
What are the key properties of 2-(furan-2-yl)-5-methyl-N-(4-methyl-1H-pyrazol-5-yl)-1,3-thiazole-4-carboxamide?
2-(furan-2-yl)-5-methyl-N-(4-methyl-1H-pyrazol-5-yl)-1,3-thiazole-4-carboxamide has a molecular weight of 288.33 g/mol, XLogP of 3.00, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-5-methyl-N-(4-methyl-1H-pyrazol-5-yl)-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 115630153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).