2-(4-fluorophenyl)-5,7,7-trimethyl-4,6-dihydro-[1,3]thiazolo[5,4-c]pyridine

C15H17FN2S — CID 145128320

IUPAC2-(4-fluorophenyl)-5,7,7-trimethyl-4,6-dihydro-[1,3]thiazolo[5,4-c]pyridine
SMILESCN1Cc2sc(-c3ccc(F)cc3)nc2C(C)(C)C1
InChIInChI=1S/C15H17FN2S/c1-15(2)9-18(3)8-12-13(15)17-14(19-12)10-4-6-11(16)7-5-10/h4-7H,8-9H2,1-3H3
InChIKeyXRJIFRISNQDTSI-UHFFFAOYSA-N
MW276.38 g/mol
LogP3.67
Rot. Bonds1

About 2-(4-fluorophenyl)-5,7,7-trimethyl-4,6-dihydro-[1,3]thiazolo[5,4-c]pyridine

2-(4-fluorophenyl)-5,7,7-trimethyl-4,6-dihydro-[1,3]thiazolo[5,4-c]pyridine (PubChem CID 145128320) has the molecular formula C15H17FN2S and a molecular weight of 276.38 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-5,7,7-trimethyl-4,6-dihydro-[1,3]thiazolo[5,4-c]pyridine.

Molecular Properties

Compound Name2-(4-fluorophenyl)-5,7,7-trimethyl-4,6-dihydro-[1,3]thiazolo[5,4-c]pyridine
PubChem CID145128320
Molecular FormulaC15H17FN2S
Molecular Weight276.38 g/mol
Exact Mass276.11
IUPAC Name2-(4-fluorophenyl)-5,7,7-trimethyl-4,6-dihydro-[1,3]thiazolo[5,4-c]pyridine
SMILESCN1Cc2sc(-c3ccc(F)cc3)nc2C(C)(C)C1
InChIInChI=1S/C15H17FN2S/c1-15(2)9-18(3)8-12-13(15)17-14(19-12)10-4-6-11(16)7-5-10/h4-7H,8-9H2,1-3H3
InChIKeyXRJIFRISNQDTSI-UHFFFAOYSA-N
XLogP3.67
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 53.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-bromophenyl)-4,4-dimethyl-5,6-dihydrocyclopenta[d][1,3]thiazole
CID 79862990
5-methyl-2-[4-(trifluoromethyl)phenyl]-4,6-dihydropyrrolo[3,4-d][1,3]thiazole
CID 145128379
2-(4-fluorophenyl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine
CID 62548084
2,5-bis(4-fluorophenyl)-4-methyl-1,3-thiazole
CID 118149754
2-(4-fluoro-2-methylphenyl)-5-methyl-4,6-dihydropyrrolo[3,4-d][1,3]thiazole
CID 145128275
2-(4-fluorophenyl)-4-methyl-1,3-thiazol-5-ol
CID 116886009
2-(4-fluorophenyl)-N-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-4-amine
CID 64975528
(3S)-1-[2-(4-fluorophenyl)-4-methyl-1,3-thiazole-5-carbonyl]-3-methylpyrrolidine-3-carboxylic acid
CID 124696319
(3R)-1-[2-(4-fluorophenyl)-4-methyl-1,3-thiazole-5-carbonyl]-3-methylpyrrolidine-3-carboxylic acid
CID 124696317
2-(4-fluorophenyl)-5-methoxy-4-methyl-1,3-thiazole
CID 116887509
2-(4-fluorophenyl)-N,5,5-trimethyl-6,7-dihydro-4H-1,3-benzothiazol-7-amine
CID 62089745
(2S)-2-[(4S,4aS,5S,6R,8aS)-2-(4-fluorophenyl)-5-hydroxy-4,8a-dimethyl-4a,5,6,7,8,9-hexahydro-4H-benzo[f][1,3]benzothiazol-6-yl]-1-pyrrolidin-1-ylpropan-1-one
CID 26763305

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-5,7,7-trimethyl-4,6-dihydro-[1,3]thiazolo[5,4-c]pyridine?
The IUPAC name of 2-(4-fluorophenyl)-5,7,7-trimethyl-4,6-dihydro-[1,3]thiazolo[5,4-c]pyridine (CID 145128320) is 2-(4-fluorophenyl)-5,7,7-trimethyl-4,6-dihydro-[1,3]thiazolo[5,4-c]pyridine.
What is the SMILES notation for 2-(4-fluorophenyl)-5,7,7-trimethyl-4,6-dihydro-[1,3]thiazolo[5,4-c]pyridine?
The canonical SMILES for 2-(4-fluorophenyl)-5,7,7-trimethyl-4,6-dihydro-[1,3]thiazolo[5,4-c]pyridine is CN1Cc2sc(-c3ccc(F)cc3)nc2C(C)(C)C1.
What is the InChIKey of 2-(4-fluorophenyl)-5,7,7-trimethyl-4,6-dihydro-[1,3]thiazolo[5,4-c]pyridine?
The InChIKey is XRJIFRISNQDTSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN2S/c1-15(2)9-18(3)8-12-13(15)17-14(19-12)10-4-6-11(16)7-5-10/h4-7H,8-9H2,1-3H3.
What are the key properties of 2-(4-fluorophenyl)-5,7,7-trimethyl-4,6-dihydro-[1,3]thiazolo[5,4-c]pyridine?
2-(4-fluorophenyl)-5,7,7-trimethyl-4,6-dihydro-[1,3]thiazolo[5,4-c]pyridine has a molecular weight of 276.38 g/mol, XLogP of 3.67, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-5,7,7-trimethyl-4,6-dihydro-[1,3]thiazolo[5,4-c]pyridine is sourced from PubChem (CID 145128320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).