(4-amino-2-methyl-1,3-thiazol-5-yl)-(3-fluorophenyl)methanone

C11H9FN2OS — CID 142153954

IUPAC(4-amino-2-methyl-1,3-thiazol-5-yl)-(3-fluorophenyl)methanone
SMILESCc1nc(N)c(C(=O)c2cccc(F)c2)s1
InChIInChI=1S/C11H9FN2OS/c1-6-14-11(13)10(16-6)9(15)7-3-2-4-8(12)5-7/h2-5H,13H2,1H3
InChIKeyVYQGIEGFHBLPDH-UHFFFAOYSA-N
MW236.27 g/mol
LogP2.40
Rot. Bonds2

About (4-amino-2-methyl-1,3-thiazol-5-yl)-(3-fluorophenyl)methanone

(4-amino-2-methyl-1,3-thiazol-5-yl)-(3-fluorophenyl)methanone (PubChem CID 142153954) has the molecular formula C11H9FN2OS and a molecular weight of 236.27 g/mol. Its IUPAC name is (4-amino-2-methyl-1,3-thiazol-5-yl)-(3-fluorophenyl)methanone.

Molecular Properties

Compound Name(4-amino-2-methyl-1,3-thiazol-5-yl)-(3-fluorophenyl)methanone
PubChem CID142153954
Molecular FormulaC11H9FN2OS
Molecular Weight236.27 g/mol
Exact Mass236.04
IUPAC Name(4-amino-2-methyl-1,3-thiazol-5-yl)-(3-fluorophenyl)methanone
SMILESCc1nc(N)c(C(=O)c2cccc(F)c2)s1
InChIInChI=1S/C11H9FN2OS/c1-6-14-11(13)10(16-6)9(15)7-3-2-4-8(12)5-7/h2-5H,13H2,1H3
InChIKeyVYQGIEGFHBLPDH-UHFFFAOYSA-N
XLogP2.40
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (4-amino-2-methyl-1,3-thiazol-5-yl)-(3-fluorophenyl)methanone 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

(4-amino-2-methyl-1,3-thiazol-5-yl)-[3-(trifluoromethyl)phenyl]methanone
CID 142830561
(3-fluorophenyl)-(2-methyl-1,3-thiazol-4-yl)methanone
CID 105079830
[4-amino-2-[(1-methylsulfonylpiperidin-4-yl)amino]-1,3-thiazol-5-yl]-(3-fluorophenyl)methanone
CID 11951616
[2-amino-4-(4-chlorophenyl)-1,3-thiazol-5-yl]-(3-fluorophenyl)methanone
CID 87075128
(4-amino-2-methyl-1,3-thiazol-5-yl)-(3-methoxyphenyl)methanone;ethane;1-(2-fluoro-4-methylphenyl)-4-methylpiperazine;methane
CID 142154092
[2-amino-4-(3-chlorophenyl)-1,3-thiazol-5-yl]-(3-fluorophenyl)methanone
CID 88566066
N-[4-[[4-amino-5-(3-fluorobenzoyl)-1,3-thiazol-2-yl]amino]cyclohexyl]-2-methylpropane-1-sulfonamide
CID 122480164
tert-butyl 4-[[4-amino-5-(3-fluorobenzoyl)-1,3-thiazol-2-yl]amino]piperidine-1-carboxylate
CID 11951440
2-(N-(4-amino-5-benzoyl-1,3-thiazol-2-yl)-3-fluoroanilino)propanamide
CID 166792585
(4-fluoro-2,6-dimethylphenyl)-(3-fluorophenyl)methanone
CID 106877008
N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-3-fluorobenzamide
CID 121122551
[3-(4-amino-2-phenyl-1,3-thiazole-5-carbonyl)phenyl]-phenylmethanone
CID 10110569

Frequently Asked Questions

What is the IUPAC name of (4-amino-2-methyl-1,3-thiazol-5-yl)-(3-fluorophenyl)methanone?
The IUPAC name of (4-amino-2-methyl-1,3-thiazol-5-yl)-(3-fluorophenyl)methanone (CID 142153954) is (4-amino-2-methyl-1,3-thiazol-5-yl)-(3-fluorophenyl)methanone.
What is the SMILES notation for (4-amino-2-methyl-1,3-thiazol-5-yl)-(3-fluorophenyl)methanone?
The canonical SMILES for (4-amino-2-methyl-1,3-thiazol-5-yl)-(3-fluorophenyl)methanone is Cc1nc(N)c(C(=O)c2cccc(F)c2)s1.
What is the InChIKey of (4-amino-2-methyl-1,3-thiazol-5-yl)-(3-fluorophenyl)methanone?
The InChIKey is VYQGIEGFHBLPDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9FN2OS/c1-6-14-11(13)10(16-6)9(15)7-3-2-4-8(12)5-7/h2-5H,13H2,1H3.
What are the key properties of (4-amino-2-methyl-1,3-thiazol-5-yl)-(3-fluorophenyl)methanone?
(4-amino-2-methyl-1,3-thiazol-5-yl)-(3-fluorophenyl)methanone has a molecular weight of 236.27 g/mol, XLogP of 2.40, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-amino-2-methyl-1,3-thiazol-5-yl)-(3-fluorophenyl)methanone is sourced from PubChem (CID 142153954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).