5-[[1-(6-methyl-2-pyridinyl)imidazole-4-carbonyl]amino]-2-pyridin-4-yl-1,3-thiazole-4-carboxamide

C19H15N7O2S — CID 71061074

About 5-[[1-(6-methyl-2-pyridinyl)imidazole-4-carbonyl]amino]-2-pyridin-4-yl-1,3-thiazole-4-carboxamide

5-[[1-(6-methyl-2-pyridinyl)imidazole-4-carbonyl]amino]-2-pyridin-4-yl-1,3-thiazole-4-carboxamide (PubChem CID 71061074) has the molecular formula C19H15N7O2S and a molecular weight of 405.44 g/mol. Its IUPAC name is 5-[[1-(6-methyl-2-pyridinyl)imidazole-4-carbonyl]amino]-2-pyridin-4-yl-1,3-thiazole-4-carboxamide.

Molecular Properties

• Compound Name: 5-[[1-(6-methyl-2-pyridinyl)imidazole-4-carbonyl]amino]-2-pyridin-4-yl-1,3-thiazole-4-carboxamide
• PubChem CID: 71061074
• Molecular Formula: C19H15N7O2S
• Molecular Weight: 405.44 g/mol
• Exact Mass: 405.10
• IUPAC Name: 5-[[1-(6-methyl-2-pyridinyl)imidazole-4-carbonyl]amino]-2-pyridin-4-yl-1,3-thiazole-4-carboxamide
• SMILES: Cc1cccc(-n2cnc(C(=O)Nc3sc(-c4ccncc4)nc3C(N)=O)c2)n1
• InChI: InChI=1S/C19H15N7O2S/c1-11-3-2-4-14(23-11)26-9-13(22-10-26)17(28)25-19-15(16(20)27)24-18(29-19)12-5-7-21-8-6-12/h2-10H,1H3,(H2,20,27)(H,25,28)
• InChIKey: AKFCNTNTSPUART-UHFFFAOYSA-N
• XLogP: 2.45
• TPSA: 128.68 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 8
• Rotatable Bonds: 5
• Heavy Atoms: 29
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	405.44
LogP ≤ 5	2.45
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of 5-[[1-(6-methyl-2-pyridinyl)imidazole-4-carbonyl]amino]-2-pyridin-4-yl-1,3-thiazole-4-carboxamide?

The IUPAC name of 5-[[1-(6-methyl-2-pyridinyl)imidazole-4-carbonyl]amino]-2-pyridin-4-yl-1,3-thiazole-4-carboxamide (CID 71061074) is 5-[[1-(6-methyl-2-pyridinyl)imidazole-4-carbonyl]amino]-2-pyridin-4-yl-1,3-thiazole-4-carboxamide.

What is the SMILES notation for 5-[[1-(6-methyl-2-pyridinyl)imidazole-4-carbonyl]amino]-2-pyridin-4-yl-1,3-thiazole-4-carboxamide?

The canonical SMILES for 5-[[1-(6-methyl-2-pyridinyl)imidazole-4-carbonyl]amino]-2-pyridin-4-yl-1,3-thiazole-4-carboxamide is Cc1cccc(-n2cnc(C(=O)Nc3sc(-c4ccncc4)nc3C(N)=O)c2)n1.

What is the InChIKey of 5-[[1-(6-methyl-2-pyridinyl)imidazole-4-carbonyl]amino]-2-pyridin-4-yl-1,3-thiazole-4-carboxamide?

The InChIKey is AKFCNTNTSPUART-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N7O2S/c1-11-3-2-4-14(23-11)26-9-13(22-10-26)17(28)25-19-15(16(20)27)24-18(29-19)12-5-7-21-8-6-12/h2-10H,1H3,(H2,20,27)(H,25,28).

What are the key properties of 5-[[1-(6-methyl-2-pyridinyl)imidazole-4-carbonyl]amino]-2-pyridin-4-yl-1,3-thiazole-4-carboxamide?

5-[[1-(6-methyl-2-pyridinyl)imidazole-4-carbonyl]amino]-2-pyridin-4-yl-1,3-thiazole-4-carboxamide has a molecular weight of 405.44 g/mol, XLogP of 2.45, 5 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[[1-(6-methyl-2-pyridinyl)imidazole-4-carbonyl]amino]-2-pyridin-4-yl-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 71061074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).