2-amino-6-[2-(5-methylfuran-2-yl)ethyl]-5,6,7,8-tetrahydro-3H-pyrido[2,3-d]pyrimidin-4-one;ethane

C16H24N4O2 — CID 155782337

About 2-amino-6-[2-(5-methylfuran-2-yl)ethyl]-5,6,7,8-tetrahydro-3H-pyrido[2,3-d]pyrimidin-4-one;ethane

2-amino-6-[2-(5-methylfuran-2-yl)ethyl]-5,6,7,8-tetrahydro-3H-pyrido[2,3-d]pyrimidin-4-one;ethane (PubChem CID 155782337) has the molecular formula C16H24N4O2 and a molecular weight of 304.39 g/mol. Its IUPAC name is 2-amino-6-[2-(5-methylfuran-2-yl)ethyl]-5,6,7,8-tetrahydro-3H-pyrido[2,3-d]pyrimidin-4-one;ethane.

Molecular Properties

• Compound Name: 2-amino-6-[2-(5-methylfuran-2-yl)ethyl]-5,6,7,8-tetrahydro-3H-pyrido[2,3-d]pyrimidin-4-one;ethane
• PubChem CID: 155782337
• Molecular Formula: C16H24N4O2
• Molecular Weight: 304.39 g/mol
• Exact Mass: 304.19
• IUPAC Name: 2-amino-6-[2-(5-methylfuran-2-yl)ethyl]-5,6,7,8-tetrahydro-3H-pyrido[2,3-d]pyrimidin-4-one;ethane
• SMILES: CC.Cc1ccc(CCC2CNc3nc(N)[nH]c(=O)c3C2)o1
• InChI: InChI=1S/C14H18N4O2.C2H6/c1-8-2-4-10(20-8)5-3-9-6-11-12(16-7-9)17-14(15)18-13(11)19;1-2/h2,4,9H,3,5-7H2,1H3,(H4,15,16,17,18,19);1-2H3
• InChIKey: KYHKIYZWUVJYAG-UHFFFAOYSA-N
• XLogP: 2.50
• TPSA: 96.94 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 5
• Rotatable Bonds: 3
• Heavy Atoms: 22
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	304.39
LogP ≤ 5	2.50
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-[2-(5-methylfuran-2-yl)ethyl]-5,6,7,8-tetrahydro-3H-pyrido[2,3-d]pyrimidin-4-one;ethane?

The IUPAC name of 2-amino-6-[2-(5-methylfuran-2-yl)ethyl]-5,6,7,8-tetrahydro-3H-pyrido[2,3-d]pyrimidin-4-one;ethane (CID 155782337) is 2-amino-6-[2-(5-methylfuran-2-yl)ethyl]-5,6,7,8-tetrahydro-3H-pyrido[2,3-d]pyrimidin-4-one;ethane.

What is the SMILES notation for 2-amino-6-[2-(5-methylfuran-2-yl)ethyl]-5,6,7,8-tetrahydro-3H-pyrido[2,3-d]pyrimidin-4-one;ethane?

The canonical SMILES for 2-amino-6-[2-(5-methylfuran-2-yl)ethyl]-5,6,7,8-tetrahydro-3H-pyrido[2,3-d]pyrimidin-4-one;ethane is CC.Cc1ccc(CCC2CNc3nc(N)[nH]c(=O)c3C2)o1.

What is the InChIKey of 2-amino-6-[2-(5-methylfuran-2-yl)ethyl]-5,6,7,8-tetrahydro-3H-pyrido[2,3-d]pyrimidin-4-one;ethane?

The InChIKey is KYHKIYZWUVJYAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2.C2H6/c1-8-2-4-10(20-8)5-3-9-6-11-12(16-7-9)17-14(15)18-13(11)19;1-2/h2,4,9H,3,5-7H2,1H3,(H4,15,16,17,18,19);1-2H3.

What are the key properties of 2-amino-6-[2-(5-methylfuran-2-yl)ethyl]-5,6,7,8-tetrahydro-3H-pyrido[2,3-d]pyrimidin-4-one;ethane?

2-amino-6-[2-(5-methylfuran-2-yl)ethyl]-5,6,7,8-tetrahydro-3H-pyrido[2,3-d]pyrimidin-4-one;ethane has a molecular weight of 304.39 g/mol, XLogP of 2.50, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-amino-6-[2-(5-methylfuran-2-yl)ethyl]-5,6,7,8-tetrahydro-3H-pyrido[2,3-d]pyrimidin-4-one;ethane is sourced from PubChem (CID 155782337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).