5-(4-chlorophenyl)-N-(1,3-thiazol-2-yl)furan-2-carboxamide

C14H9ClN2O2S — CID 1084411

IUPAC5-(4-chlorophenyl)-N-(1,3-thiazol-2-yl)furan-2-carboxamide
SMILESO=C(Nc1nccs1)c1ccc(-c2ccc(Cl)cc2)o1
InChIInChI=1S/C14H9ClN2O2S/c15-10-3-1-9(2-4-10)11-5-6-12(19-11)13(18)17-14-16-7-8-20-14/h1-8H,(H,16,17,18)
InChIKeyBTJDPQCUBBJLPC-UHFFFAOYSA-N
MW304.76 g/mol
LogP4.31
Rot. Bonds3

About 5-(4-chlorophenyl)-N-(1,3-thiazol-2-yl)furan-2-carboxamide

5-(4-chlorophenyl)-N-(1,3-thiazol-2-yl)furan-2-carboxamide (PubChem CID 1084411) has the molecular formula C14H9ClN2O2S and a molecular weight of 304.76 g/mol. Its IUPAC name is 5-(4-chlorophenyl)-N-(1,3-thiazol-2-yl)furan-2-carboxamide.

Molecular Properties

Compound Name5-(4-chlorophenyl)-N-(1,3-thiazol-2-yl)furan-2-carboxamide
PubChem CID1084411
Molecular FormulaC14H9ClN2O2S
Molecular Weight304.76 g/mol
Exact Mass304.01
IUPAC Name5-(4-chlorophenyl)-N-(1,3-thiazol-2-yl)furan-2-carboxamide
SMILESO=C(Nc1nccs1)c1ccc(-c2ccc(Cl)cc2)o1
InChIInChI=1S/C14H9ClN2O2S/c15-10-3-1-9(2-4-10)11-5-6-12(19-11)13(18)17-14-16-7-8-20-14/h1-8H,(H,16,17,18)
InChIKeyBTJDPQCUBBJLPC-UHFFFAOYSA-N
XLogP4.31
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.76
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-(4-chlorophenyl)-N-(1,3-thiazol-2-yl)furan-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-(4-chlorophenyl)-N-(1,3-thiazol-2-yl)furan-2-carboxamide?
The IUPAC name of 5-(4-chlorophenyl)-N-(1,3-thiazol-2-yl)furan-2-carboxamide (CID 1084411) is 5-(4-chlorophenyl)-N-(1,3-thiazol-2-yl)furan-2-carboxamide.
What is the SMILES notation for 5-(4-chlorophenyl)-N-(1,3-thiazol-2-yl)furan-2-carboxamide?
The canonical SMILES for 5-(4-chlorophenyl)-N-(1,3-thiazol-2-yl)furan-2-carboxamide is O=C(Nc1nccs1)c1ccc(-c2ccc(Cl)cc2)o1.
What is the InChIKey of 5-(4-chlorophenyl)-N-(1,3-thiazol-2-yl)furan-2-carboxamide?
The InChIKey is BTJDPQCUBBJLPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9ClN2O2S/c15-10-3-1-9(2-4-10)11-5-6-12(19-11)13(18)17-14-16-7-8-20-14/h1-8H,(H,16,17,18).
What are the key properties of 5-(4-chlorophenyl)-N-(1,3-thiazol-2-yl)furan-2-carboxamide?
5-(4-chlorophenyl)-N-(1,3-thiazol-2-yl)furan-2-carboxamide has a molecular weight of 304.76 g/mol, XLogP of 4.31, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-chlorophenyl)-N-(1,3-thiazol-2-yl)furan-2-carboxamide is sourced from PubChem (CID 1084411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).