2-(furan-2-yl)-N-(1-methylpyrazol-4-yl)-4-phenyl-1,3-thiazole-5-carboxamide

C18H14N4O2S — CID 32608675

IUPAC2-(furan-2-yl)-N-(1-methylpyrazol-4-yl)-4-phenyl-1,3-thiazole-5-carboxamide
SMILESCn1cc(NC(=O)c2sc(-c3ccco3)nc2-c2ccccc2)cn1
InChIInChI=1S/C18H14N4O2S/c1-22-11-13(10-19-22)20-17(23)16-15(12-6-3-2-4-7-12)21-18(25-16)14-8-5-9-24-14/h2-11H,1H3,(H,20,23)
InChIKeyMOJFFOBSCIMZFB-UHFFFAOYSA-N
MW350.40 g/mol
LogP4.06
Rot. Bonds4

About 2-(furan-2-yl)-N-(1-methylpyrazol-4-yl)-4-phenyl-1,3-thiazole-5-carboxamide

2-(furan-2-yl)-N-(1-methylpyrazol-4-yl)-4-phenyl-1,3-thiazole-5-carboxamide (PubChem CID 32608675) has the molecular formula C18H14N4O2S and a molecular weight of 350.40 g/mol. Its IUPAC name is 2-(furan-2-yl)-N-(1-methylpyrazol-4-yl)-4-phenyl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name2-(furan-2-yl)-N-(1-methylpyrazol-4-yl)-4-phenyl-1,3-thiazole-5-carboxamide
PubChem CID32608675
Molecular FormulaC18H14N4O2S
Molecular Weight350.40 g/mol
Exact Mass350.08
IUPAC Name2-(furan-2-yl)-N-(1-methylpyrazol-4-yl)-4-phenyl-1,3-thiazole-5-carboxamide
SMILESCn1cc(NC(=O)c2sc(-c3ccco3)nc2-c2ccccc2)cn1
InChIInChI=1S/C18H14N4O2S/c1-22-11-13(10-19-22)20-17(23)16-15(12-6-3-2-4-7-12)21-18(25-16)14-8-5-9-24-14/h2-11H,1H3,(H,20,23)
InChIKeyMOJFFOBSCIMZFB-UHFFFAOYSA-N
XLogP4.06
TPSA72.95 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.40
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(furan-2-yl)-N-(2-hydroxyphenyl)-4-phenyl-1,3-thiazole-5-carboxamide
CID 36766447
2-(furan-2-yl)-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-4-phenyl-1,3-thiazole-5-carboxamide
CID 55610356
2-(furan-2-yl)-4-phenyl-N-piperidin-4-yl-1,3-thiazole-5-carboxamide;dihydrochloride
CID 119385843
N'-[2-(furan-2-yl)-4-phenyl-1,3-thiazole-5-carbonyl]-4-methyl-2-morpholin-4-yl-1,3-thiazole-5-carbohydrazide
CID 36757551
[2-(furan-2-yl)-4-phenyl-1,3-thiazol-5-yl]-morpholin-4-ylmethanone
CID 36704275
2-(furan-2-yl)-N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-4-phenyl-1,3-thiazole-5-carboxamide
CID 55585334
N-(8-azabicyclo[3.2.1]octan-3-yl)-2-(furan-2-yl)-4-phenyl-1,3-thiazole-5-carboxamide;dihydrochloride
CID 119455202
2-(furan-2-yl)-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]-4-phenyl-1,3-thiazole-5-carboxamide
CID 56552353
N-(3,4-dihydro-2H-chromen-4-yl)-2-(furan-2-yl)-4-phenyl-1,3-thiazole-5-carboxamide
CID 46551376
N-[4-[5-(acetamidomethyl)furan-2-yl]-1,3-thiazol-2-yl]-2-(furan-2-yl)-4-phenyl-1,3-thiazole-5-carboxamide
CID 36799563
N-(3-acetamidophenyl)-2,4-diphenyl-1,3-thiazole-5-carboxamide
CID 9074270
5-methyl-N-(1-methylpyrazol-4-yl)-2-phenyl-1,3-oxazole-4-carboxamide
CID 32606809

Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-N-(1-methylpyrazol-4-yl)-4-phenyl-1,3-thiazole-5-carboxamide?
The IUPAC name of 2-(furan-2-yl)-N-(1-methylpyrazol-4-yl)-4-phenyl-1,3-thiazole-5-carboxamide (CID 32608675) is 2-(furan-2-yl)-N-(1-methylpyrazol-4-yl)-4-phenyl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 2-(furan-2-yl)-N-(1-methylpyrazol-4-yl)-4-phenyl-1,3-thiazole-5-carboxamide?
The canonical SMILES for 2-(furan-2-yl)-N-(1-methylpyrazol-4-yl)-4-phenyl-1,3-thiazole-5-carboxamide is Cn1cc(NC(=O)c2sc(-c3ccco3)nc2-c2ccccc2)cn1.
What is the InChIKey of 2-(furan-2-yl)-N-(1-methylpyrazol-4-yl)-4-phenyl-1,3-thiazole-5-carboxamide?
The InChIKey is MOJFFOBSCIMZFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N4O2S/c1-22-11-13(10-19-22)20-17(23)16-15(12-6-3-2-4-7-12)21-18(25-16)14-8-5-9-24-14/h2-11H,1H3,(H,20,23).
What are the key properties of 2-(furan-2-yl)-N-(1-methylpyrazol-4-yl)-4-phenyl-1,3-thiazole-5-carboxamide?
2-(furan-2-yl)-N-(1-methylpyrazol-4-yl)-4-phenyl-1,3-thiazole-5-carboxamide has a molecular weight of 350.40 g/mol, XLogP of 4.06, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-N-(1-methylpyrazol-4-yl)-4-phenyl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 32608675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).