N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide

C16H20N6OS — CID 51108343

IUPACN-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide
SMILESCN1CCc2nc(NC(=O)c3ccc(N4CCCC4)nn3)sc2C1
InChIInChI=1S/C16H20N6OS/c1-21-9-6-11-13(10-21)24-16(17-11)18-15(23)12-4-5-14(20-19-12)22-7-2-3-8-22/h4-5H,2-3,6-10H2,1H3,(H,17,18,23)
InChIKeyMZGKPPZCVDRDCO-UHFFFAOYSA-N
MW344.44 g/mol
LogP1.77
Rot. Bonds3

About N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide

N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide (PubChem CID 51108343) has the molecular formula C16H20N6OS and a molecular weight of 344.44 g/mol. Its IUPAC name is N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide
PubChem CID51108343
Molecular FormulaC16H20N6OS
Molecular Weight344.44 g/mol
Exact Mass344.14
IUPAC NameN-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide
SMILESCN1CCc2nc(NC(=O)c3ccc(N4CCCC4)nn3)sc2C1
InChIInChI=1S/C16H20N6OS/c1-21-9-6-11-13(10-21)24-16(17-11)18-15(23)12-4-5-14(20-19-12)22-7-2-3-8-22/h4-5H,2-3,6-10H2,1H3,(H,17,18,23)
InChIKeyMZGKPPZCVDRDCO-UHFFFAOYSA-N
XLogP1.77
TPSA74.25 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.44
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

5-methyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)pyrazine-2-carboxamide
CID 46663904
5-methyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-1,2-oxazole-3-carboxamide;hydrochloride
CID 16848015
N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)thiophene-2-carboxamide
CID 29173142
2,4-dichloro-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide
CID 27421659
5-(4-chlorophenyl)-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-1,2-oxazole-3-carboxamide
CID 35340823
N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-5-piperidin-1-ylsulfonylfuran-2-carboxamide
CID 55634612
N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2-oxo-2-piperidin-1-ylacetamide
CID 108517269
4-cyano-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;hydrochloride
CID 44826980
3-bromo-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide
CID 27421670
2-methoxy-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide
CID 15282280
4,5-dimethyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)thiophene-3-carboxamide
CID 84560679
4-methyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)naphthalene-1-carboxamide
CID 167914935

Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide?
The IUPAC name of N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide (CID 51108343) is N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide.
What is the SMILES notation for N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide?
The canonical SMILES for N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide is CN1CCc2nc(NC(=O)c3ccc(N4CCCC4)nn3)sc2C1.
What is the InChIKey of N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide?
The InChIKey is MZGKPPZCVDRDCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N6OS/c1-21-9-6-11-13(10-21)24-16(17-11)18-15(23)12-4-5-14(20-19-12)22-7-2-3-8-22/h4-5H,2-3,6-10H2,1H3,(H,17,18,23).
What are the key properties of N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide?
N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide has a molecular weight of 344.44 g/mol, XLogP of 1.77, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide is sourced from PubChem (CID 51108343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).