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

C13H17N5O2S — CID 167972155

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

3-methoxy-1-methyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)pyrazole-4-carboxamide (PubChem CID 167972155) has the molecular formula C13H17N5O2S and a molecular weight of 307.38 g/mol. Its IUPAC name is 3-methoxy-1-methyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)pyrazole-4-carboxamide.

Molecular Properties

• Compound Name: 3-methoxy-1-methyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)pyrazole-4-carboxamide
• PubChem CID: 167972155
• Molecular Formula: C13H17N5O2S
• Molecular Weight: 307.38 g/mol
• Exact Mass: 307.11
• IUPAC Name: 3-methoxy-1-methyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)pyrazole-4-carboxamide
• SMILES: COc1nn(C)cc1C(=O)Nc1nc2c(s1)CN(C)CC2
• InChI: InChI=1S/C13H17N5O2S/c1-17-5-4-9-10(7-17)21-13(14-9)15-11(19)8-6-18(2)16-12(8)20-3/h6H,4-5,7H2,1-3H3,(H,14,15,19)
• InChIKey: ZFFVDQAWJXUOHJ-UHFFFAOYSA-N
• XLogP: 1.13
• TPSA: 72.28 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 3
• Heavy Atoms: 21
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	307.38
LogP ≤ 5	1.13
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-1-methyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)pyrazole-4-carboxamide?

The IUPAC name of 3-methoxy-1-methyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)pyrazole-4-carboxamide (CID 167972155) is 3-methoxy-1-methyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)pyrazole-4-carboxamide.

What is the SMILES notation for 3-methoxy-1-methyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)pyrazole-4-carboxamide?

The canonical SMILES for 3-methoxy-1-methyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)pyrazole-4-carboxamide is COc1nn(C)cc1C(=O)Nc1nc2c(s1)CN(C)CC2.

What is the InChIKey of 3-methoxy-1-methyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)pyrazole-4-carboxamide?

The InChIKey is ZFFVDQAWJXUOHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5O2S/c1-17-5-4-9-10(7-17)21-13(14-9)15-11(19)8-6-18(2)16-12(8)20-3/h6H,4-5,7H2,1-3H3,(H,14,15,19).

What are the key properties of 3-methoxy-1-methyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)pyrazole-4-carboxamide?

3-methoxy-1-methyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)pyrazole-4-carboxamide has a molecular weight of 307.38 g/mol, XLogP of 1.13, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 3-methoxy-1-methyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)pyrazole-4-carboxamide is sourced from PubChem (CID 167972155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).