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

C14H17N3OS2 — CID 84560679

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

4,5-dimethyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)thiophene-3-carboxamide (PubChem CID 84560679) has the molecular formula C14H17N3OS2 and a molecular weight of 307.44 g/mol. Its IUPAC name is 4,5-dimethyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)thiophene-3-carboxamide.

Molecular Properties

• Compound Name: 4,5-dimethyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)thiophene-3-carboxamide
• PubChem CID: 84560679
• Molecular Formula: C14H17N3OS2
• Molecular Weight: 307.44 g/mol
• Exact Mass: 307.08
• IUPAC Name: 4,5-dimethyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)thiophene-3-carboxamide
• SMILES: Cc1scc(C(=O)Nc2nc3c(s2)CN(C)CC3)c1C
• InChI: InChI=1S/C14H17N3OS2/c1-8-9(2)19-7-10(8)13(18)16-14-15-11-4-5-17(3)6-12(11)20-14/h7H,4-6H2,1-3H3,(H,15,16,18)
• InChIKey: YEHYQQFPAALGTQ-UHFFFAOYSA-N
• XLogP: 3.06
• TPSA: 45.23 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 2
• Heavy Atoms: 20
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	307.44
LogP ≤ 5	3.06
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

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

The IUPAC name of 4,5-dimethyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)thiophene-3-carboxamide (CID 84560679) is 4,5-dimethyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)thiophene-3-carboxamide.

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

The canonical SMILES for 4,5-dimethyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)thiophene-3-carboxamide is Cc1scc(C(=O)Nc2nc3c(s2)CN(C)CC3)c1C.

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

The InChIKey is YEHYQQFPAALGTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3OS2/c1-8-9(2)19-7-10(8)13(18)16-14-15-11-4-5-17(3)6-12(11)20-14/h7H,4-6H2,1-3H3,(H,15,16,18).

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

4,5-dimethyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)thiophene-3-carboxamide has a molecular weight of 307.44 g/mol, XLogP of 3.06, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 4,5-dimethyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)thiophene-3-carboxamide is sourced from PubChem (CID 84560679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).