N-(6,7-dimethyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)benzamide;ethane

C17H19N3OS — CID 154659407

IUPACN-(6,7-dimethyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)benzamide;ethane
SMILESCC.Cc1ncc2nc(NC(=O)c3ccccc3)sc2c1C
InChIInChI=1S/C15H13N3OS.C2H6/c1-9-10(2)16-8-12-13(9)20-15(17-12)18-14(19)11-6-4-3-5-7-11;1-2/h3-8H,1-2H3,(H,17,18,19);1-2H3
InChIKeyKUEIWOILGDSCSO-UHFFFAOYSA-N
MW313.43 g/mol
LogP4.59
Rot. Bonds2

About N-(6,7-dimethyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)benzamide;ethane

N-(6,7-dimethyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)benzamide;ethane (PubChem CID 154659407) has the molecular formula C17H19N3OS and a molecular weight of 313.43 g/mol. Its IUPAC name is N-(6,7-dimethyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)benzamide;ethane.

Molecular Properties

Compound NameN-(6,7-dimethyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)benzamide;ethane
PubChem CID154659407
Molecular FormulaC17H19N3OS
Molecular Weight313.43 g/mol
Exact Mass313.12
IUPAC NameN-(6,7-dimethyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)benzamide;ethane
SMILESCC.Cc1ncc2nc(NC(=O)c3ccccc3)sc2c1C
InChIInChI=1S/C15H13N3OS.C2H6/c1-9-10(2)16-8-12-13(9)20-15(17-12)18-14(19)11-6-4-3-5-7-11;1-2/h3-8H,1-2H3,(H,17,18,19);1-2H3
InChIKeyKUEIWOILGDSCSO-UHFFFAOYSA-N
XLogP4.59
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.43
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(7-bromo-6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)benzamide
CID 142524471
N-(7-bromo-6-chloro-[1,3]thiazolo[4,5-c]pyridin-2-yl)benzamide
CID 171486825
N-(5-benzoyl-4-methyl-1,3-thiazol-2-yl)benzamide
CID 7315330
2-benzamido-1,3-benzothiazole-6-carboxylic acid
CID 19622650
2-(2-benzamido-4-methyl-1,3-thiazol-5-yl)acetic acid
CID 82058764
N-(5,6-difluoro-1,3-benzothiazol-2-yl)benzamide
CID 142741981
N-(7-methyl-4-nitro-1,3-benzothiazol-2-yl)benzamide
CID 22015740
N-(4,6-dimethyl-1,3-benzothiazol-2-yl)benzamide
CID 4307053
3-(2-benzamido-4-methyl-1,3-thiazol-5-yl)propanoic acid
CID 82058794
N-(7-nitro-1,3-benzothiazol-2-yl)benzamide
CID 13481964
N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-(2-oxo-2-phenylacetyl)benzamide
CID 19209994
N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)benzamide
CID 7192494

Frequently Asked Questions

What is the IUPAC name of N-(6,7-dimethyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)benzamide;ethane?
The IUPAC name of N-(6,7-dimethyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)benzamide;ethane (CID 154659407) is N-(6,7-dimethyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)benzamide;ethane.
What is the SMILES notation for N-(6,7-dimethyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)benzamide;ethane?
The canonical SMILES for N-(6,7-dimethyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)benzamide;ethane is CC.Cc1ncc2nc(NC(=O)c3ccccc3)sc2c1C.
What is the InChIKey of N-(6,7-dimethyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)benzamide;ethane?
The InChIKey is KUEIWOILGDSCSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3OS.C2H6/c1-9-10(2)16-8-12-13(9)20-15(17-12)18-14(19)11-6-4-3-5-7-11;1-2/h3-8H,1-2H3,(H,17,18,19);1-2H3.
What are the key properties of N-(6,7-dimethyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)benzamide;ethane?
N-(6,7-dimethyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)benzamide;ethane has a molecular weight of 313.43 g/mol, XLogP of 4.59, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6,7-dimethyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)benzamide;ethane is sourced from PubChem (CID 154659407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).