N-(morpholin-2-ylmethyl)-7-(6-morpholin-4-yl-3-pyridinyl)pyrido[3,4-b]pyrazin-5-amine;hydrochloride

C21H26ClN7O2 — CID 66555381

About N-(morpholin-2-ylmethyl)-7-(6-morpholin-4-yl-3-pyridinyl)pyrido[3,4-b]pyrazin-5-amine;hydrochloride

N-(morpholin-2-ylmethyl)-7-(6-morpholin-4-yl-3-pyridinyl)pyrido[3,4-b]pyrazin-5-amine;hydrochloride (PubChem CID 66555381) has the molecular formula C21H26ClN7O2 and a molecular weight of 443.94 g/mol. Its IUPAC name is N-(morpholin-2-ylmethyl)-7-(6-morpholin-4-yl-3-pyridinyl)pyrido[3,4-b]pyrazin-5-amine;hydrochloride.

Molecular Properties

• Compound Name: N-(morpholin-2-ylmethyl)-7-(6-morpholin-4-yl-3-pyridinyl)pyrido[3,4-b]pyrazin-5-amine;hydrochloride
• PubChem CID: 66555381
• Molecular Formula: C21H26ClN7O2
• Molecular Weight: 443.94 g/mol
• Exact Mass: 443.18
• IUPAC Name: N-(morpholin-2-ylmethyl)-7-(6-morpholin-4-yl-3-pyridinyl)pyrido[3,4-b]pyrazin-5-amine;hydrochloride
• SMILES: Cl.c1cnc2c(NCC3CNCCO3)nc(-c3ccc(N4CCOCC4)nc3)cc2n1
• InChI: InChI=1S/C21H25N7O2.ClH/c1-2-19(28-6-9-29-10-7-28)25-12-15(1)17-11-18-20(24-4-3-23-18)21(27-17)26-14-16-13-22-5-8-30-16;/h1-4,11-12,16,22H,5-10,13-14H2,(H,26,27);1H
• InChIKey: FGPAZKDQZRVZRN-UHFFFAOYSA-N
• XLogP: 1.75
• TPSA: 97.32 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 9
• Rotatable Bonds: 5
• Heavy Atoms: 31
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	443.94
LogP ≤ 5	1.75
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	9

Frequently Asked Questions

What is the IUPAC name of N-(morpholin-2-ylmethyl)-7-(6-morpholin-4-yl-3-pyridinyl)pyrido[3,4-b]pyrazin-5-amine;hydrochloride?

The IUPAC name of N-(morpholin-2-ylmethyl)-7-(6-morpholin-4-yl-3-pyridinyl)pyrido[3,4-b]pyrazin-5-amine;hydrochloride (CID 66555381) is N-(morpholin-2-ylmethyl)-7-(6-morpholin-4-yl-3-pyridinyl)pyrido[3,4-b]pyrazin-5-amine;hydrochloride.

What is the SMILES notation for N-(morpholin-2-ylmethyl)-7-(6-morpholin-4-yl-3-pyridinyl)pyrido[3,4-b]pyrazin-5-amine;hydrochloride?

The canonical SMILES for N-(morpholin-2-ylmethyl)-7-(6-morpholin-4-yl-3-pyridinyl)pyrido[3,4-b]pyrazin-5-amine;hydrochloride is Cl.c1cnc2c(NCC3CNCCO3)nc(-c3ccc(N4CCOCC4)nc3)cc2n1.

What is the InChIKey of N-(morpholin-2-ylmethyl)-7-(6-morpholin-4-yl-3-pyridinyl)pyrido[3,4-b]pyrazin-5-amine;hydrochloride?

The InChIKey is FGPAZKDQZRVZRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N7O2.ClH/c1-2-19(28-6-9-29-10-7-28)25-12-15(1)17-11-18-20(24-4-3-23-18)21(27-17)26-14-16-13-22-5-8-30-16;/h1-4,11-12,16,22H,5-10,13-14H2,(H,26,27);1H.

What are the key properties of N-(morpholin-2-ylmethyl)-7-(6-morpholin-4-yl-3-pyridinyl)pyrido[3,4-b]pyrazin-5-amine;hydrochloride?

N-(morpholin-2-ylmethyl)-7-(6-morpholin-4-yl-3-pyridinyl)pyrido[3,4-b]pyrazin-5-amine;hydrochloride has a molecular weight of 443.94 g/mol, XLogP of 1.75, 5 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for N-(morpholin-2-ylmethyl)-7-(6-morpholin-4-yl-3-pyridinyl)pyrido[3,4-b]pyrazin-5-amine;hydrochloride is sourced from PubChem (CID 66555381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).