2-(5-fluoro-1H-indole-3-carbonyl)-N-methyl-1,3-thiazole-4-carboxamide

C14H10FN3O2S — CID 147680873

IUPAC2-(5-fluoro-1H-indole-3-carbonyl)-N-methyl-1,3-thiazole-4-carboxamide
SMILESCNC(=O)c1csc(C(=O)c2c[nH]c3ccc(F)cc23)n1
InChIInChI=1S/C14H10FN3O2S/c1-16-13(20)11-6-21-14(18-11)12(19)9-5-17-10-3-2-7(15)4-8(9)10/h2-6,17H,1H3,(H,16,20)
InChIKeyGPCGHQYPRDZLRO-UHFFFAOYSA-N
MW303.32 g/mol
LogP2.35
Rot. Bonds3

About 2-(5-fluoro-1H-indole-3-carbonyl)-N-methyl-1,3-thiazole-4-carboxamide

2-(5-fluoro-1H-indole-3-carbonyl)-N-methyl-1,3-thiazole-4-carboxamide (PubChem CID 147680873) has the molecular formula C14H10FN3O2S and a molecular weight of 303.32 g/mol. Its IUPAC name is 2-(5-fluoro-1H-indole-3-carbonyl)-N-methyl-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-(5-fluoro-1H-indole-3-carbonyl)-N-methyl-1,3-thiazole-4-carboxamide
PubChem CID147680873
Molecular FormulaC14H10FN3O2S
Molecular Weight303.32 g/mol
Exact Mass303.05
IUPAC Name2-(5-fluoro-1H-indole-3-carbonyl)-N-methyl-1,3-thiazole-4-carboxamide
SMILESCNC(=O)c1csc(C(=O)c2c[nH]c3ccc(F)cc23)n1
InChIInChI=1S/C14H10FN3O2S/c1-16-13(20)11-6-21-14(18-11)12(19)9-5-17-10-3-2-7(15)4-8(9)10/h2-6,17H,1H3,(H,16,20)
InChIKeyGPCGHQYPRDZLRO-UHFFFAOYSA-N
XLogP2.35
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.32
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(5-fluoro-1H-indole-3-carbonyl)-N-methyl-1,3-thiazole-4-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 2-(5-fluoro-1H-indole-3-carbonyl)-N-methyl-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-(5-fluoro-1H-indole-3-carbonyl)-N-methyl-1,3-thiazole-4-carboxamide (CID 147680873) is 2-(5-fluoro-1H-indole-3-carbonyl)-N-methyl-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-(5-fluoro-1H-indole-3-carbonyl)-N-methyl-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-(5-fluoro-1H-indole-3-carbonyl)-N-methyl-1,3-thiazole-4-carboxamide is CNC(=O)c1csc(C(=O)c2c[nH]c3ccc(F)cc23)n1.
What is the InChIKey of 2-(5-fluoro-1H-indole-3-carbonyl)-N-methyl-1,3-thiazole-4-carboxamide?
The InChIKey is GPCGHQYPRDZLRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10FN3O2S/c1-16-13(20)11-6-21-14(18-11)12(19)9-5-17-10-3-2-7(15)4-8(9)10/h2-6,17H,1H3,(H,16,20).
What are the key properties of 2-(5-fluoro-1H-indole-3-carbonyl)-N-methyl-1,3-thiazole-4-carboxamide?
2-(5-fluoro-1H-indole-3-carbonyl)-N-methyl-1,3-thiazole-4-carboxamide has a molecular weight of 303.32 g/mol, XLogP of 2.35, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-fluoro-1H-indole-3-carbonyl)-N-methyl-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 147680873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).