2,6-difluoro-3-[(6-propyl-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]benzamide

C17H15F2N3O2S — CID 59403032

IUPAC2,6-difluoro-3-[(6-propyl-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]benzamide
SMILESCCCc1cnc2sc(COc3ccc(F)c(C(N)=O)c3F)nc2c1
InChIInChI=1S/C17H15F2N3O2S/c1-2-3-9-6-11-17(21-7-9)25-13(22-11)8-24-12-5-4-10(18)14(15(12)19)16(20)23/h4-7H,2-3,8H2,1H3,(H2,20,23)
InChIKeyYVNRIKIECWNVTE-UHFFFAOYSA-N
MW363.39 g/mol
LogP3.60
Rot. Bonds6

About 2,6-difluoro-3-[(6-propyl-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]benzamide

2,6-difluoro-3-[(6-propyl-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]benzamide (PubChem CID 59403032) has the molecular formula C17H15F2N3O2S and a molecular weight of 363.39 g/mol. Its IUPAC name is 2,6-difluoro-3-[(6-propyl-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]benzamide.

Molecular Properties

Compound Name2,6-difluoro-3-[(6-propyl-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]benzamide
PubChem CID59403032
Molecular FormulaC17H15F2N3O2S
Molecular Weight363.39 g/mol
Exact Mass363.09
IUPAC Name2,6-difluoro-3-[(6-propyl-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]benzamide
SMILESCCCc1cnc2sc(COc3ccc(F)c(C(N)=O)c3F)nc2c1
InChIInChI=1S/C17H15F2N3O2S/c1-2-3-9-6-11-17(21-7-9)25-13(22-11)8-24-12-5-4-10(18)14(15(12)19)16(20)23/h4-7H,2-3,8H2,1H3,(H2,20,23)
InChIKeyYVNRIKIECWNVTE-UHFFFAOYSA-N
XLogP3.60
TPSA78.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.39
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2,6-difluoro-3-[(6-methyl-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]benzamide
CID 67506078
2,6-difluoro-3-[[6-(1,1,2,2,2-pentafluoroethyl)-[1,3]thiazolo[5,4-b]pyridin-2-yl]methoxy]benzamide
CID 90154016
2,6-difluoro-3-([1,3]thiazolo[5,4-b]pyridin-2-ylmethoxy)benzamide;ethane
CID 142447134
2,6-difluoro-3-[[6-(1-methylpyrrol-2-yl)-[1,3]thiazolo[5,4-b]pyridin-2-yl]methoxy]benzamide
CID 59402799
2,6-difluoro-3-[(6-methyl-1,3-benzothiazol-2-yl)methoxy]benzamide
CID 46237268
3-[(5-ethoxy-1,3-benzothiazol-2-yl)methoxy]-2,6-difluorobenzamide
CID 46237012
methyl 2-[(3-carbamoyl-2,4-difluorophenoxy)methyl]-1,3-benzothiazole-6-carboxylate
CID 59402909
2,6-difluoro-3-[(5-phenyl-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]benzamide
CID 66620086
2,6-difluoro-3-[(4-methyl-1,3-thiazol-2-yl)methoxy]benzamide;ethane
CID 143542941
3-[[5-(cyclopenten-1-yl)-1,3-benzothiazol-2-yl]methoxy]-2,6-difluorobenzamide
CID 59402666
2,6-difluoro-3-[(4-methyl-1,3-benzothiazol-2-yl)methoxy]benzamide
CID 46237267
N-[3-[(6-chloro-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]-2,6-difluorobenzoyl]carbamoyl fluoride
CID 118069617

Frequently Asked Questions

What is the IUPAC name of 2,6-difluoro-3-[(6-propyl-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]benzamide?
The IUPAC name of 2,6-difluoro-3-[(6-propyl-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]benzamide (CID 59403032) is 2,6-difluoro-3-[(6-propyl-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]benzamide.
What is the SMILES notation for 2,6-difluoro-3-[(6-propyl-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]benzamide?
The canonical SMILES for 2,6-difluoro-3-[(6-propyl-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]benzamide is CCCc1cnc2sc(COc3ccc(F)c(C(N)=O)c3F)nc2c1.
What is the InChIKey of 2,6-difluoro-3-[(6-propyl-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]benzamide?
The InChIKey is YVNRIKIECWNVTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15F2N3O2S/c1-2-3-9-6-11-17(21-7-9)25-13(22-11)8-24-12-5-4-10(18)14(15(12)19)16(20)23/h4-7H,2-3,8H2,1H3,(H2,20,23).
What are the key properties of 2,6-difluoro-3-[(6-propyl-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]benzamide?
2,6-difluoro-3-[(6-propyl-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]benzamide has a molecular weight of 363.39 g/mol, XLogP of 3.60, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-difluoro-3-[(6-propyl-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]benzamide is sourced from PubChem (CID 59403032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).