2-(furan-2-yl)-5-methyl-N-[4-(propylcarbamoyl)phenyl]-1,3-thiazole-4-carboxamide

C19H19N3O3S — CID 55893940

IUPAC2-(furan-2-yl)-5-methyl-N-[4-(propylcarbamoyl)phenyl]-1,3-thiazole-4-carboxamide
SMILESCCCNC(=O)c1ccc(NC(=O)c2nc(-c3ccco3)sc2C)cc1
InChIInChI=1S/C19H19N3O3S/c1-3-10-20-17(23)13-6-8-14(9-7-13)21-18(24)16-12(2)26-19(22-16)15-5-4-11-25-15/h4-9,11H,3,10H2,1-2H3,(H,20,23)(H,21,24)
InChIKeyLTMCOMMQIYWUOO-UHFFFAOYSA-N
MW369.45 g/mol
LogP4.10
Rot. Bonds6

About 2-(furan-2-yl)-5-methyl-N-[4-(propylcarbamoyl)phenyl]-1,3-thiazole-4-carboxamide

2-(furan-2-yl)-5-methyl-N-[4-(propylcarbamoyl)phenyl]-1,3-thiazole-4-carboxamide (PubChem CID 55893940) has the molecular formula C19H19N3O3S and a molecular weight of 369.45 g/mol. Its IUPAC name is 2-(furan-2-yl)-5-methyl-N-[4-(propylcarbamoyl)phenyl]-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-(furan-2-yl)-5-methyl-N-[4-(propylcarbamoyl)phenyl]-1,3-thiazole-4-carboxamide
PubChem CID55893940
Molecular FormulaC19H19N3O3S
Molecular Weight369.45 g/mol
Exact Mass369.11
IUPAC Name2-(furan-2-yl)-5-methyl-N-[4-(propylcarbamoyl)phenyl]-1,3-thiazole-4-carboxamide
SMILESCCCNC(=O)c1ccc(NC(=O)c2nc(-c3ccco3)sc2C)cc1
InChIInChI=1S/C19H19N3O3S/c1-3-10-20-17(23)13-6-8-14(9-7-13)21-18(24)16-12(2)26-19(22-16)15-5-4-11-25-15/h4-9,11H,3,10H2,1-2H3,(H,20,23)(H,21,24)
InChIKeyLTMCOMMQIYWUOO-UHFFFAOYSA-N
XLogP4.10
TPSA84.23 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.45
LogP ≤ 54.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[4-(carbamoylamino)phenyl]methyl]-2-(furan-2-yl)-5-methyl-1,3-thiazole-4-carboxamide
CID 134054764
2-(furan-2-yl)-5-methyl-1,3-thiazole-4-carbohydrazide
CID 43244788
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
CID 78956621
2-(furan-2-yl)-5-methyl-N-(4-methyl-1H-pyrazol-5-yl)-1,3-thiazole-4-carboxamide
CID 115630153
N-(3-amino-2-methylpropyl)-2-(furan-2-yl)-5-methyl-1,3-thiazole-4-carboxamide
CID 119997754
2-(furan-2-yl)-N-(2-methoxyethoxy)-5-methyl-1,3-thiazole-4-carboxamide
CID 79676397
4-methyl-2-phenyl-N-[4-(propylcarbamoyl)phenyl]-1,3-thiazole-5-carboxamide
CID 55892921
2-(furan-2-yl)-N-(2-hydroxy-4-methylphenyl)-5-methyl-1,3-thiazole-4-carboxamide
CID 134018768
1-N,4-N-bis[4-(propylcarbamoyl)phenyl]benzene-1,4-dicarboxamide
CID 17219360
1-[[[2-(furan-2-yl)-5-methyl-1,3-thiazole-4-carbonyl]amino]methyl]cyclohexane-1-carboxylic acid
CID 120544577
2-(furan-2-yl)-5-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]-1,3-thiazole-4-carboxamide
CID 55834234

Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-5-methyl-N-[4-(propylcarbamoyl)phenyl]-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-(furan-2-yl)-5-methyl-N-[4-(propylcarbamoyl)phenyl]-1,3-thiazole-4-carboxamide (CID 55893940) is 2-(furan-2-yl)-5-methyl-N-[4-(propylcarbamoyl)phenyl]-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-(furan-2-yl)-5-methyl-N-[4-(propylcarbamoyl)phenyl]-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-(furan-2-yl)-5-methyl-N-[4-(propylcarbamoyl)phenyl]-1,3-thiazole-4-carboxamide is CCCNC(=O)c1ccc(NC(=O)c2nc(-c3ccco3)sc2C)cc1.
What is the InChIKey of 2-(furan-2-yl)-5-methyl-N-[4-(propylcarbamoyl)phenyl]-1,3-thiazole-4-carboxamide?
The InChIKey is LTMCOMMQIYWUOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O3S/c1-3-10-20-17(23)13-6-8-14(9-7-13)21-18(24)16-12(2)26-19(22-16)15-5-4-11-25-15/h4-9,11H,3,10H2,1-2H3,(H,20,23)(H,21,24).
What are the key properties of 2-(furan-2-yl)-5-methyl-N-[4-(propylcarbamoyl)phenyl]-1,3-thiazole-4-carboxamide?
2-(furan-2-yl)-5-methyl-N-[4-(propylcarbamoyl)phenyl]-1,3-thiazole-4-carboxamide has a molecular weight of 369.45 g/mol, XLogP of 4.10, 6 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-(propylcarbamoyl)phenyl]-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 55893940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).