6-(5-methyl-2-pyridinyl)-N-(quinolin-6-ylmethyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-amine

C23H22N6 — CID 59346510

About 6-(5-methyl-2-pyridinyl)-N-(quinolin-6-ylmethyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-amine

6-(5-methyl-2-pyridinyl)-N-(quinolin-6-ylmethyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-amine (PubChem CID 59346510) has the molecular formula C23H22N6 and a molecular weight of 382.47 g/mol. Its IUPAC name is 6-(5-methyl-2-pyridinyl)-N-(quinolin-6-ylmethyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-amine.

Molecular Properties

• Compound Name: 6-(5-methyl-2-pyridinyl)-N-(quinolin-6-ylmethyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-amine
• PubChem CID: 59346510
• Molecular Formula: C23H22N6
• Molecular Weight: 382.47 g/mol
• Exact Mass: 382.19
• IUPAC Name: 6-(5-methyl-2-pyridinyl)-N-(quinolin-6-ylmethyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-amine
• SMILES: Cc1ccc(N2CCc3ncnc(NCc4ccc5ncccc5c4)c3C2)nc1
• InChI: InChI=1S/C23H22N6/c1-16-4-7-22(25-12-16)29-10-8-21-19(14-29)23(28-15-27-21)26-13-17-5-6-20-18(11-17)3-2-9-24-20/h2-7,9,11-12,15H,8,10,13-14H2,1H3,(H,26,27,28)
• InChIKey: AEHIINFTNVHXBJ-UHFFFAOYSA-N
• XLogP: 3.90
• TPSA: 66.83 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 4
• Heavy Atoms: 29
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	382.47
LogP ≤ 5	3.90
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 6-(5-methyl-2-pyridinyl)-N-(quinolin-6-ylmethyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-amine?

The IUPAC name of 6-(5-methyl-2-pyridinyl)-N-(quinolin-6-ylmethyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-amine (CID 59346510) is 6-(5-methyl-2-pyridinyl)-N-(quinolin-6-ylmethyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-amine.

What is the SMILES notation for 6-(5-methyl-2-pyridinyl)-N-(quinolin-6-ylmethyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-amine?

The canonical SMILES for 6-(5-methyl-2-pyridinyl)-N-(quinolin-6-ylmethyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-amine is Cc1ccc(N2CCc3ncnc(NCc4ccc5ncccc5c4)c3C2)nc1.

What is the InChIKey of 6-(5-methyl-2-pyridinyl)-N-(quinolin-6-ylmethyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-amine?

The InChIKey is AEHIINFTNVHXBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N6/c1-16-4-7-22(25-12-16)29-10-8-21-19(14-29)23(28-15-27-21)26-13-17-5-6-20-18(11-17)3-2-9-24-20/h2-7,9,11-12,15H,8,10,13-14H2,1H3,(H,26,27,28).

What are the key properties of 6-(5-methyl-2-pyridinyl)-N-(quinolin-6-ylmethyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-amine?

6-(5-methyl-2-pyridinyl)-N-(quinolin-6-ylmethyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-amine has a molecular weight of 382.47 g/mol, XLogP of 3.90, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 6-(5-methyl-2-pyridinyl)-N-(quinolin-6-ylmethyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-amine is sourced from PubChem (CID 59346510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).