2,6-difluoro-3-([1,3]thiazolo[5,4-b]pyridin-2-ylmethoxy)benzamide;ethane

C16H15F2N3O2S — CID 142447134

IUPAC2,6-difluoro-3-([1,3]thiazolo[5,4-b]pyridin-2-ylmethoxy)benzamide;ethane
SMILESCC.NC(=O)c1c(F)ccc(OCc2nc3cccnc3s2)c1F
InChIInChI=1S/C14H9F2N3O2S.C2H6/c15-7-3-4-9(12(16)11(7)13(17)20)21-6-10-19-8-2-1-5-18-14(8)22-10;1-2/h1-5H,6H2,(H2,17,20);1-2H3
InChIKeyQZGLVKOYUKYPJH-UHFFFAOYSA-N
MW351.38 g/mol
LogP3.67
Rot. Bonds4

About 2,6-difluoro-3-([1,3]thiazolo[5,4-b]pyridin-2-ylmethoxy)benzamide;ethane

2,6-difluoro-3-([1,3]thiazolo[5,4-b]pyridin-2-ylmethoxy)benzamide;ethane (PubChem CID 142447134) has the molecular formula C16H15F2N3O2S and a molecular weight of 351.38 g/mol. Its IUPAC name is 2,6-difluoro-3-([1,3]thiazolo[5,4-b]pyridin-2-ylmethoxy)benzamide;ethane.

Molecular Properties

Compound Name2,6-difluoro-3-([1,3]thiazolo[5,4-b]pyridin-2-ylmethoxy)benzamide;ethane
PubChem CID142447134
Molecular FormulaC16H15F2N3O2S
Molecular Weight351.38 g/mol
Exact Mass351.09
IUPAC Name2,6-difluoro-3-([1,3]thiazolo[5,4-b]pyridin-2-ylmethoxy)benzamide;ethane
SMILESCC.NC(=O)c1c(F)ccc(OCc2nc3cccnc3s2)c1F
InChIInChI=1S/C14H9F2N3O2S.C2H6/c15-7-3-4-9(12(16)11(7)13(17)20)21-6-10-19-8-2-1-5-18-14(8)22-10;1-2/h1-5H,6H2,(H2,17,20);1-2H3
InChIKeyQZGLVKOYUKYPJH-UHFFFAOYSA-N
XLogP3.67
TPSA78.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.38
LogP ≤ 53.67
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-[(5-phenyl-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]benzamide
CID 66620086
2,6-difluoro-3-[(6-propyl-[1,3]thiazolo[5,4-b]pyridin-2-yl)methoxy]benzamide
CID 59403032
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-(1,1,2,2,2-pentafluoroethyl)-[1,3]thiazolo[5,4-b]pyridin-2-yl]methoxy]benzamide
CID 90154016
2,6-difluoro-3-[(6-methyl-1,3-benzothiazol-2-yl)methoxy]benzamide
CID 46237268
2,6-difluoro-3-[(4-methyl-1,3-thiazol-2-yl)methoxy]benzamide;ethane
CID 143542941
2,6-difluoro-3-[(4-methyl-1,3-benzothiazol-2-yl)methoxy]benzamide
CID 46237267
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-[[4-(4-methoxyphenyl)-5-(1,3-thiazol-2-yl)-1,3-thiazol-2-yl]methoxy]benzamide
CID 59402708
2,6-difluoro-3-(quinolin-7-ylmethoxy)benzamide
CID 59402735

Frequently Asked Questions

What is the IUPAC name of 2,6-difluoro-3-([1,3]thiazolo[5,4-b]pyridin-2-ylmethoxy)benzamide;ethane?
The IUPAC name of 2,6-difluoro-3-([1,3]thiazolo[5,4-b]pyridin-2-ylmethoxy)benzamide;ethane (CID 142447134) is 2,6-difluoro-3-([1,3]thiazolo[5,4-b]pyridin-2-ylmethoxy)benzamide;ethane.
What is the SMILES notation for 2,6-difluoro-3-([1,3]thiazolo[5,4-b]pyridin-2-ylmethoxy)benzamide;ethane?
The canonical SMILES for 2,6-difluoro-3-([1,3]thiazolo[5,4-b]pyridin-2-ylmethoxy)benzamide;ethane is CC.NC(=O)c1c(F)ccc(OCc2nc3cccnc3s2)c1F.
What is the InChIKey of 2,6-difluoro-3-([1,3]thiazolo[5,4-b]pyridin-2-ylmethoxy)benzamide;ethane?
The InChIKey is QZGLVKOYUKYPJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9F2N3O2S.C2H6/c15-7-3-4-9(12(16)11(7)13(17)20)21-6-10-19-8-2-1-5-18-14(8)22-10;1-2/h1-5H,6H2,(H2,17,20);1-2H3.
What are the key properties of 2,6-difluoro-3-([1,3]thiazolo[5,4-b]pyridin-2-ylmethoxy)benzamide;ethane?
2,6-difluoro-3-([1,3]thiazolo[5,4-b]pyridin-2-ylmethoxy)benzamide;ethane has a molecular weight of 351.38 g/mol, XLogP of 3.67, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-difluoro-3-([1,3]thiazolo[5,4-b]pyridin-2-ylmethoxy)benzamide;ethane is sourced from PubChem (CID 142447134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).