1-(6-methyl-3-pyridinyl)-3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ylmethyl)urea

C15H19N5O — CID 128995677

About 1-(6-methyl-3-pyridinyl)-3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ylmethyl)urea

1-(6-methyl-3-pyridinyl)-3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ylmethyl)urea (PubChem CID 128995677) has the molecular formula C15H19N5O and a molecular weight of 285.35 g/mol. Its IUPAC name is 1-(6-methyl-3-pyridinyl)-3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ylmethyl)urea.

Molecular Properties

• Compound Name: 1-(6-methyl-3-pyridinyl)-3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ylmethyl)urea
• PubChem CID: 128995677
• Molecular Formula: C15H19N5O
• Molecular Weight: 285.35 g/mol
• Exact Mass: 285.16
• IUPAC Name: 1-(6-methyl-3-pyridinyl)-3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ylmethyl)urea
• SMILES: Cc1ccc(NC(=O)NCC2CCc3nccn3C2)cn1
• InChI: InChI=1S/C15H19N5O/c1-11-2-4-13(9-17-11)19-15(21)18-8-12-3-5-14-16-6-7-20(14)10-12/h2,4,6-7,9,12H,3,5,8,10H2,1H3,(H2,18,19,21)
• InChIKey: HPHGUWNLEMNBKE-UHFFFAOYSA-N
• XLogP: 1.97
• TPSA: 71.84 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 4
• Rotatable Bonds: 3
• Heavy Atoms: 21
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	285.35
LogP ≤ 5	1.97
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of 1-(6-methyl-3-pyridinyl)-3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ylmethyl)urea?

The IUPAC name of 1-(6-methyl-3-pyridinyl)-3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ylmethyl)urea (CID 128995677) is 1-(6-methyl-3-pyridinyl)-3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ylmethyl)urea.

What is the SMILES notation for 1-(6-methyl-3-pyridinyl)-3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ylmethyl)urea?

The canonical SMILES for 1-(6-methyl-3-pyridinyl)-3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ylmethyl)urea is Cc1ccc(NC(=O)NCC2CCc3nccn3C2)cn1.

What is the InChIKey of 1-(6-methyl-3-pyridinyl)-3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ylmethyl)urea?

The InChIKey is HPHGUWNLEMNBKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O/c1-11-2-4-13(9-17-11)19-15(21)18-8-12-3-5-14-16-6-7-20(14)10-12/h2,4,6-7,9,12H,3,5,8,10H2,1H3,(H2,18,19,21).

What are the key properties of 1-(6-methyl-3-pyridinyl)-3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ylmethyl)urea?

1-(6-methyl-3-pyridinyl)-3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ylmethyl)urea has a molecular weight of 285.35 g/mol, XLogP of 1.97, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(6-methyl-3-pyridinyl)-3-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-ylmethyl)urea is sourced from PubChem (CID 128995677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).