N-(1,3-thiazol-2-yl)-6-[3-(trifluoromethyl)phenyl]-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxamide;6-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine

C32H24F6N6O3S — CID 159122322

IUPACN-(1,3-thiazol-2-yl)-6-[3-(trifluoromethyl)phenyl]-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxamide;6-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine
SMILESFC(F)(F)c1cccc(-c2ccc3c(n2)NCCO3)c1.O=C(Nc1nccs1)N1CCOc2ccc(-c3cccc(C(F)(F)F)c3)nc21
InChIInChI=1S/C18H13F3N4O2S.C14H11F3N2O/c19-18(20,21)12-3-1-2-11(10-12)13-4-5-14-15(23-13)25(7-8-27-14)17(26)24-16-22-6-9-28-16;15-14(16,17)10-3-1-2-9(8-10)11-4-5-12-13(19-11)18-6-7-20-12/h1-6,9-10H,7-8H2,(H,22,24,26);1-5,8H,6-7H2,(H,18,19)
InChIKeyKFVSNYVFEWXNLH-UHFFFAOYSA-N
MW686.64 g/mol
LogP8.23
Rot. Bonds3

About N-(1,3-thiazol-2-yl)-6-[3-(trifluoromethyl)phenyl]-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxamide;6-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine

N-(1,3-thiazol-2-yl)-6-[3-(trifluoromethyl)phenyl]-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxamide;6-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine (PubChem CID 159122322) has the molecular formula C32H24F6N6O3S and a molecular weight of 686.64 g/mol. Its IUPAC name is N-(1,3-thiazol-2-yl)-6-[3-(trifluoromethyl)phenyl]-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxamide;6-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine.

Molecular Properties

Compound NameN-(1,3-thiazol-2-yl)-6-[3-(trifluoromethyl)phenyl]-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxamide;6-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine
PubChem CID159122322
Molecular FormulaC32H24F6N6O3S
Molecular Weight686.64 g/mol
Exact Mass686.15
IUPAC NameN-(1,3-thiazol-2-yl)-6-[3-(trifluoromethyl)phenyl]-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxamide;6-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine
SMILESFC(F)(F)c1cccc(-c2ccc3c(n2)NCCO3)c1.O=C(Nc1nccs1)N1CCOc2ccc(-c3cccc(C(F)(F)F)c3)nc21
InChIInChI=1S/C18H13F3N4O2S.C14H11F3N2O/c19-18(20,21)12-3-1-2-11(10-12)13-4-5-14-15(23-13)25(7-8-27-14)17(26)24-16-22-6-9-28-16;15-14(16,17)10-3-1-2-9(8-10)11-4-5-12-13(19-11)18-6-7-20-12/h1-6,9-10H,7-8H2,(H,22,24,26);1-5,8H,6-7H2,(H,18,19)
InChIKeyKFVSNYVFEWXNLH-UHFFFAOYSA-N
XLogP8.23
TPSA101.50 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms48
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500686.64
LogP ≤ 58.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze N-(1,3-thiazol-2-yl)-6-[3-(trifluoromethyl)phenyl]-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxamide;6-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine 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-methyl-N-[3-(quinolin-8-ylmethoxy)-2-pyridinyl]-1,3-thiazol-2-amine
CID 16660167
4-[6-[[4-(1-Acetylpiperidin-4-yl)-1,3-thiazol-2-yl]amino]-5-phenoxypyridin-3-yl]sulfanyl-3-(trifluoromethyl)benzonitrile
CID 25099724
N-(thiazol-2-yl)-6-(3-(trifluoromethyl)phenyl)-2H-pyrido[3,2-b][1,4]oxazine-4(3H)-carboxamide
CID 52914962
N-pyridin-2-yl-6-[3-(trifluoromethyl)phenyl]-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxamide
CID 53233106
N-(2-pyrrolidin-1-ylpyridin-4-yl)-6-[3-(trifluoromethyl)phenyl]-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxamide
CID 53233229
N-(5-fluoropyridin-2-yl)-6-[3-(trifluoromethyl)phenyl]-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxamide
CID 53233675
N-(4-methyl-1,3-thiazol-2-yl)-7-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazepine-5-carboxamide
CID 53233778
1-[4-[2-[[3-(4-Fluoro-2-methylphenoxy)-5-(3-methoxyphenyl)sulfanyl-2-pyridinyl]amino]-1,3-thiazol-4-yl]piperidin-1-yl]ethanone
CID 57742694
1-[4-[2-[[3-Phenoxy-5-[6-(trifluoromethyl)pyridin-3-yl]sulfanylpyridin-2-yl]amino]-1,3-thiazol-4-yl]piperidin-1-yl]ethanone
CID 57742879
N-[4-(1,3-thiazol-2-ylamino)phenyl]-2-[8-(trifluoromethyl)quinolin-4-yl]oxyacetamide
CID 57936455
2-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-N-(1,3-thiazol-2-yl)acetamide
CID 59152250
2-[[6-(2-fluorophenyl)-3-pyridinyl]oxy]-N-(1,3-thiazol-2-yl)acetamide
CID 59152270

Frequently Asked Questions

What is the IUPAC name of N-(1,3-thiazol-2-yl)-6-[3-(trifluoromethyl)phenyl]-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxamide;6-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine?
The IUPAC name of N-(1,3-thiazol-2-yl)-6-[3-(trifluoromethyl)phenyl]-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxamide;6-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine (CID 159122322) is N-(1,3-thiazol-2-yl)-6-[3-(trifluoromethyl)phenyl]-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxamide;6-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine.
What is the SMILES notation for N-(1,3-thiazol-2-yl)-6-[3-(trifluoromethyl)phenyl]-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxamide;6-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine?
The canonical SMILES for N-(1,3-thiazol-2-yl)-6-[3-(trifluoromethyl)phenyl]-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxamide;6-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine is FC(F)(F)c1cccc(-c2ccc3c(n2)NCCO3)c1.O=C(Nc1nccs1)N1CCOc2ccc(-c3cccc(C(F)(F)F)c3)nc21.
What is the InChIKey of N-(1,3-thiazol-2-yl)-6-[3-(trifluoromethyl)phenyl]-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxamide;6-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine?
The InChIKey is KFVSNYVFEWXNLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13F3N4O2S.C14H11F3N2O/c19-18(20,21)12-3-1-2-11(10-12)13-4-5-14-15(23-13)25(7-8-27-14)17(26)24-16-22-6-9-28-16;15-14(16,17)10-3-1-2-9(8-10)11-4-5-12-13(19-11)18-6-7-20-12/h1-6,9-10H,7-8H2,(H,22,24,26);1-5,8H,6-7H2,(H,18,19).
What are the key properties of N-(1,3-thiazol-2-yl)-6-[3-(trifluoromethyl)phenyl]-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxamide;6-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine?
N-(1,3-thiazol-2-yl)-6-[3-(trifluoromethyl)phenyl]-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxamide;6-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine has a molecular weight of 686.64 g/mol, XLogP of 8.23, 3 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-thiazol-2-yl)-6-[3-(trifluoromethyl)phenyl]-2,3-dihydropyrido[3,2-b][1,4]oxazine-4-carboxamide;6-[3-(trifluoromethyl)phenyl]-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine is sourced from PubChem (CID 159122322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).