N-(6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)-2H-pyrrole-5-carboxamide

C12H10N4OS — CID 130354604

IUPACN-(6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)-2H-pyrrole-5-carboxamide
SMILESCc1cc2sc(NC(=O)C3=NCC=C3)nc2cn1
InChIInChI=1S/C12H10N4OS/c1-7-5-10-9(6-14-7)15-12(18-10)16-11(17)8-3-2-4-13-8/h2-3,5-6H,4H2,1H3,(H,15,16,17)
InChIKeyGPQYCNMGBSXBBG-UHFFFAOYSA-N
MW258.31 g/mol
LogP1.95
Rot. Bonds2

About N-(6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)-2H-pyrrole-5-carboxamide

N-(6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)-2H-pyrrole-5-carboxamide (PubChem CID 130354604) has the molecular formula C12H10N4OS and a molecular weight of 258.31 g/mol. Its IUPAC name is N-(6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)-2H-pyrrole-5-carboxamide.

Molecular Properties

Compound NameN-(6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)-2H-pyrrole-5-carboxamide
PubChem CID130354604
Molecular FormulaC12H10N4OS
Molecular Weight258.31 g/mol
Exact Mass258.06
IUPAC NameN-(6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)-2H-pyrrole-5-carboxamide
SMILESCc1cc2sc(NC(=O)C3=NCC=C3)nc2cn1
InChIInChI=1S/C12H10N4OS/c1-7-5-10-9(6-14-7)15-12(18-10)16-11(17)8-3-2-4-13-8/h2-3,5-6H,4H2,1H3,(H,15,16,17)
InChIKeyGPQYCNMGBSXBBG-UHFFFAOYSA-N
XLogP1.95
TPSA67.24 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.31
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)-1H-pyrazole-5-carboxamide
CID 130354570
N-(6-methoxy-[1,3]thiazolo[4,5-c]pyridin-2-yl)benzamide;5-methyl-N-(6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)-1,2-oxazole-3-carboxamide;N-(6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)furan-2-carboxamide;N-(6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)-1,3-oxazole-2-carboxamide;N-(6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)-2H-pyrrole-5-carboxamide;N-(6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)thiophene-2-carboxamide;N-(6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)thiophene-3-carboxamide
CID 158900001
N-(6-methoxy-1,3-benzothiazol-2-yl)-6-methylpyridine-3-carboxamide
CID 18147913
6-methyl-N-(6-methyl-1,3-benzothiazol-2-yl)pyridine-2-carboxamide
CID 31809959
2-N,5-N-bis(6-methyl-1,3-benzothiazol-2-yl)pyridine-2,5-dicarboxamide
CID 4652334
N-(6-methoxy-1,3-benzothiazol-2-yl)-2-methyl-1,3-oxazole-5-carboxamide
CID 110702338
N-(5,6-dimethyl-1,3-benzothiazol-2-yl)naphthalene-2-carboxamide
CID 8670065
4-(methylamino)-N-(6-methyl-1,3-benzothiazol-2-yl)pyridine-3-carboxamide
CID 81237659
N-([1,3]dioxolo[4,5-f][1,3]benzothiazol-6-yl)-2-methylbenzamide
CID 7189878
4-methyl-N-[2-[(4-methylbenzoyl)amino]-1,3-benzothiazol-6-yl]benzamide
CID 23741959
N-(6,7-dimethyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)benzamide;ethane
CID 154659407
N-(6-methoxy-1,3-benzothiazol-2-yl)-3-methyl-1,2-oxazole-5-carboxamide
CID 16879597

Frequently Asked Questions

What is the IUPAC name of N-(6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)-2H-pyrrole-5-carboxamide?
The IUPAC name of N-(6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)-2H-pyrrole-5-carboxamide (CID 130354604) is N-(6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)-2H-pyrrole-5-carboxamide.
What is the SMILES notation for N-(6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)-2H-pyrrole-5-carboxamide?
The canonical SMILES for N-(6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)-2H-pyrrole-5-carboxamide is Cc1cc2sc(NC(=O)C3=NCC=C3)nc2cn1.
What is the InChIKey of N-(6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)-2H-pyrrole-5-carboxamide?
The InChIKey is GPQYCNMGBSXBBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N4OS/c1-7-5-10-9(6-14-7)15-12(18-10)16-11(17)8-3-2-4-13-8/h2-3,5-6H,4H2,1H3,(H,15,16,17).
What are the key properties of N-(6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)-2H-pyrrole-5-carboxamide?
N-(6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)-2H-pyrrole-5-carboxamide has a molecular weight of 258.31 g/mol, XLogP of 1.95, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)-2H-pyrrole-5-carboxamide is sourced from PubChem (CID 130354604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).