2-(4-fluorophenyl)-N-prop-2-ynylimidazo[2,1-b][1,3]thiazole-6-carboxamide

C15H10FN3OS — CID 134797117

IUPAC2-(4-fluorophenyl)-N-prop-2-ynylimidazo[2,1-b][1,3]thiazole-6-carboxamide
SMILESC#CCNC(=O)c1cn2cc(-c3ccc(F)cc3)sc2n1
InChIInChI=1S/C15H10FN3OS/c1-2-7-17-14(20)12-8-19-9-13(21-15(19)18-12)10-3-5-11(16)6-4-10/h1,3-6,8-9H,7H2,(H,17,20)
InChIKeyRROPZLZBDSMDJQ-UHFFFAOYSA-N
MW299.33 g/mol
LogP2.56
Rot. Bonds3

About 2-(4-fluorophenyl)-N-prop-2-ynylimidazo[2,1-b][1,3]thiazole-6-carboxamide

2-(4-fluorophenyl)-N-prop-2-ynylimidazo[2,1-b][1,3]thiazole-6-carboxamide (PubChem CID 134797117) has the molecular formula C15H10FN3OS and a molecular weight of 299.33 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-N-prop-2-ynylimidazo[2,1-b][1,3]thiazole-6-carboxamide.

Molecular Properties

Compound Name2-(4-fluorophenyl)-N-prop-2-ynylimidazo[2,1-b][1,3]thiazole-6-carboxamide
PubChem CID134797117
Molecular FormulaC15H10FN3OS
Molecular Weight299.33 g/mol
Exact Mass299.05
IUPAC Name2-(4-fluorophenyl)-N-prop-2-ynylimidazo[2,1-b][1,3]thiazole-6-carboxamide
SMILESC#CCNC(=O)c1cn2cc(-c3ccc(F)cc3)sc2n1
InChIInChI=1S/C15H10FN3OS/c1-2-7-17-14(20)12-8-19-9-13(21-15(19)18-12)10-3-5-11(16)6-4-10/h1,3-6,8-9H,7H2,(H,17,20)
InChIKeyRROPZLZBDSMDJQ-UHFFFAOYSA-N
XLogP2.56
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.33
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze 2-(4-fluorophenyl)-N-prop-2-ynylimidazo[2,1-b][1,3]thiazole-6-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

N-(2-methylpropyl)-2-[4-(trifluoromethyl)phenyl]imidazo[2,1-b][1,3]thiazole-6-carboxamide
CID 134798652
N-benzyl-2-(4-methylphenyl)imidazo[2,1-b][1,3]thiazole-6-carboxamide
CID 134795851
N-(3-methoxypropyl)-2-(4-methylphenyl)imidazo[2,1-b][1,3]thiazole-6-carboxamide
CID 134797314
[2-(4-fluorophenyl)imidazo[2,1-b][1,3]thiazol-6-yl]-(4-methylpiperazin-1-yl)methanone
CID 134798241
2-(4-methoxyphenyl)-N-[2-(4-methoxyphenyl)ethyl]imidazo[2,1-b][1,3]thiazole-6-carboxamide
CID 134799938
N-[(3,4-difluorophenyl)methyl]-2-[4-(trifluoromethyl)phenyl]imidazo[2,1-b][1,3]thiazole-6-carboxamide
CID 134798964
4-(18F)fluoro-N-prop-2-ynyl(18F)benzamide
CID 87412012
N-(cyclopropylmethyl)-2-phenylimidazo[2,1-b][1,3]thiazole-6-carboxamide
CID 134798879
2-(4-methoxyphenyl)-N-(2-phenylethyl)imidazo[2,1-b][1,3]thiazole-6-carboxamide
CID 134796452
2-[4-(trifluoromethyl)phenyl]-N-[[3-(trifluoromethyl)phenyl]methyl]imidazo[2,1-b][1,3]thiazole-6-carboxamide
CID 134799413
2-(4-methoxyphenyl)-N-[(3-methoxyphenyl)methyl]imidazo[2,1-b][1,3]thiazole-6-carboxamide
CID 134795965
2-[3-(trifluoromethyl)phenyl]-N-[[3-(trifluoromethyl)phenyl]methyl]imidazo[2,1-b][1,3]thiazole-6-carboxamide
CID 134796480

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-N-prop-2-ynylimidazo[2,1-b][1,3]thiazole-6-carboxamide?
The IUPAC name of 2-(4-fluorophenyl)-N-prop-2-ynylimidazo[2,1-b][1,3]thiazole-6-carboxamide (CID 134797117) is 2-(4-fluorophenyl)-N-prop-2-ynylimidazo[2,1-b][1,3]thiazole-6-carboxamide.
What is the SMILES notation for 2-(4-fluorophenyl)-N-prop-2-ynylimidazo[2,1-b][1,3]thiazole-6-carboxamide?
The canonical SMILES for 2-(4-fluorophenyl)-N-prop-2-ynylimidazo[2,1-b][1,3]thiazole-6-carboxamide is C#CCNC(=O)c1cn2cc(-c3ccc(F)cc3)sc2n1.
What is the InChIKey of 2-(4-fluorophenyl)-N-prop-2-ynylimidazo[2,1-b][1,3]thiazole-6-carboxamide?
The InChIKey is RROPZLZBDSMDJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10FN3OS/c1-2-7-17-14(20)12-8-19-9-13(21-15(19)18-12)10-3-5-11(16)6-4-10/h1,3-6,8-9H,7H2,(H,17,20).
What are the key properties of 2-(4-fluorophenyl)-N-prop-2-ynylimidazo[2,1-b][1,3]thiazole-6-carboxamide?
2-(4-fluorophenyl)-N-prop-2-ynylimidazo[2,1-b][1,3]thiazole-6-carboxamide has a molecular weight of 299.33 g/mol, XLogP of 2.56, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-N-prop-2-ynylimidazo[2,1-b][1,3]thiazole-6-carboxamide is sourced from PubChem (CID 134797117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).