N-[4-(1,3-thiazol-2-ylcarbamoyl)phenyl]furan-2-carboxamide

C15H11N3O3S — CID 652401

IUPACN-[4-(1,3-thiazol-2-ylcarbamoyl)phenyl]furan-2-carboxamide
SMILESO=C(Nc1nccs1)c1ccc(NC(=O)c2ccco2)cc1
InChIInChI=1S/C15H11N3O3S/c19-13(18-15-16-7-9-22-15)10-3-5-11(6-4-10)17-14(20)12-2-1-8-21-12/h1-9H,(H,17,20)(H,16,18,19)
InChIKeyOAVQGDUZVDBKKR-UHFFFAOYSA-N
MW313.34 g/mol
LogP3.24
Rot. Bonds4

About N-[4-(1,3-thiazol-2-ylcarbamoyl)phenyl]furan-2-carboxamide

N-[4-(1,3-thiazol-2-ylcarbamoyl)phenyl]furan-2-carboxamide (PubChem CID 652401) has the molecular formula C15H11N3O3S and a molecular weight of 313.34 g/mol. Its IUPAC name is N-[4-(1,3-thiazol-2-ylcarbamoyl)phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[4-(1,3-thiazol-2-ylcarbamoyl)phenyl]furan-2-carboxamide
PubChem CID652401
Molecular FormulaC15H11N3O3S
Molecular Weight313.34 g/mol
Exact Mass313.05
IUPAC NameN-[4-(1,3-thiazol-2-ylcarbamoyl)phenyl]furan-2-carboxamide
SMILESO=C(Nc1nccs1)c1ccc(NC(=O)c2ccco2)cc1
InChIInChI=1S/C15H11N3O3S/c19-13(18-15-16-7-9-22-15)10-3-5-11(6-4-10)17-14(20)12-2-1-8-21-12/h1-9H,(H,17,20)(H,16,18,19)
InChIKeyOAVQGDUZVDBKKR-UHFFFAOYSA-N
XLogP3.24
TPSA84.23 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.34
LogP ≤ 53.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(phenoxymethyl)-N-(1,3-thiazol-2-yl)furan-2-carboxamide
CID 2967498
N-(2-chloro-6-methylphenyl)-2-[(2-furanylcarbonyl)amino]-1,3-thiazole-5-carboxamide
CID 21911324
Furan-2-carboxylic acid (4-phenyl-5-pyridin-4-yl-thiazol-2-yl)-amide
CID 72197880
5-(4-fluorophenyl)-N-(1,3-thiazol-2-yl)furan-2-carboxamide
CID 1249045
5-{[(4-methylphenyl)sulfanyl]methyl}-N-(1,3-thiazol-2-yl)furan-2-carboxamide
CID 2990742
N-(5-methyl-1,3-thiazol-2-yl)-5-(4-nitrophenyl)furan-2-carboxamide
CID 4782855
N-[4-(2-amino-1,3-thiazol-4-yl)phenyl]furan-2-carboxamide
CID 8893265
N-[3-(1,3-thiazol-2-ylcarbamoyl)phenyl]furan-2-carboxamide
CID 746004
N-[5-(4-methylbenzyl)-1,3-thiazol-2-yl]-2-furamide
CID 724162
N-[5-[(4-fluorophenyl)methyl]-1,3-thiazol-2-yl]-5-methylfuran-2-carboxamide
CID 646081
N-(3-{2-[(Furan-2-ylmethyl)-amino]-thiazol-4-yl}-phenyl)-acetamide
CID 647705
5-[(4-methylphenoxy)methyl]-N-(1,3-thiazol-2-yl)furan-2-carboxamide
CID 648119

Frequently Asked Questions

What is the IUPAC name of N-[4-(1,3-thiazol-2-ylcarbamoyl)phenyl]furan-2-carboxamide?
The IUPAC name of N-[4-(1,3-thiazol-2-ylcarbamoyl)phenyl]furan-2-carboxamide (CID 652401) is N-[4-(1,3-thiazol-2-ylcarbamoyl)phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[4-(1,3-thiazol-2-ylcarbamoyl)phenyl]furan-2-carboxamide?
The canonical SMILES for N-[4-(1,3-thiazol-2-ylcarbamoyl)phenyl]furan-2-carboxamide is O=C(Nc1nccs1)c1ccc(NC(=O)c2ccco2)cc1.
What is the InChIKey of N-[4-(1,3-thiazol-2-ylcarbamoyl)phenyl]furan-2-carboxamide?
The InChIKey is OAVQGDUZVDBKKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N3O3S/c19-13(18-15-16-7-9-22-15)10-3-5-11(6-4-10)17-14(20)12-2-1-8-21-12/h1-9H,(H,17,20)(H,16,18,19).
What are the key properties of N-[4-(1,3-thiazol-2-ylcarbamoyl)phenyl]furan-2-carboxamide?
N-[4-(1,3-thiazol-2-ylcarbamoyl)phenyl]furan-2-carboxamide has a molecular weight of 313.34 g/mol, XLogP of 3.24, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(1,3-thiazol-2-ylcarbamoyl)phenyl]furan-2-carboxamide is sourced from PubChem (CID 652401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).