N-[6-[(2R)-4-[(8-methoxyquinolin-2-yl)methyl]morpholin-2-yl]-3-pyridinyl]-6-methylpyridin-2-amine

C26H27N5O2 — CID 124951705

About N-[6-[(2R)-4-[(8-methoxyquinolin-2-yl)methyl]morpholin-2-yl]-3-pyridinyl]-6-methylpyridin-2-amine

N-[6-[(2R)-4-[(8-methoxyquinolin-2-yl)methyl]morpholin-2-yl]-3-pyridinyl]-6-methylpyridin-2-amine (PubChem CID 124951705) has the molecular formula C26H27N5O2 and a molecular weight of 441.54 g/mol. Its IUPAC name is N-[6-[(2R)-4-[(8-methoxyquinolin-2-yl)methyl]morpholin-2-yl]-3-pyridinyl]-6-methylpyridin-2-amine.

Molecular Properties

• Compound Name: N-[6-[(2R)-4-[(8-methoxyquinolin-2-yl)methyl]morpholin-2-yl]-3-pyridinyl]-6-methylpyridin-2-amine
• PubChem CID: 124951705
• Molecular Formula: C26H27N5O2
• Molecular Weight: 441.54 g/mol
• Exact Mass: 441.22
• IUPAC Name: N-[6-[(2R)-4-[(8-methoxyquinolin-2-yl)methyl]morpholin-2-yl]-3-pyridinyl]-6-methylpyridin-2-amine
• SMILES: COc1cccc2ccc(CN3CCO[C@@H](c4ccc(Nc5cccc(C)n5)cn4)C3)nc12
• InChI: InChI=1S/C26H27N5O2/c1-18-5-3-8-25(28-18)29-20-11-12-22(27-15-20)24-17-31(13-14-33-24)16-21-10-9-19-6-4-7-23(32-2)26(19)30-21/h3-12,15,24H,13-14,16-17H2,1-2H3,(H,28,29)/t24-/m1/s1
• InChIKey: DJMJEWBKAFHALY-XMMPIXPASA-N
• XLogP: 4.66
• TPSA: 72.40 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 6
• Heavy Atoms: 33
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	441.54
LogP ≤ 5	4.66
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of N-[6-[(2R)-4-[(8-methoxyquinolin-2-yl)methyl]morpholin-2-yl]-3-pyridinyl]-6-methylpyridin-2-amine?

The IUPAC name of N-[6-[(2R)-4-[(8-methoxyquinolin-2-yl)methyl]morpholin-2-yl]-3-pyridinyl]-6-methylpyridin-2-amine (CID 124951705) is N-[6-[(2R)-4-[(8-methoxyquinolin-2-yl)methyl]morpholin-2-yl]-3-pyridinyl]-6-methylpyridin-2-amine.

What is the SMILES notation for N-[6-[(2R)-4-[(8-methoxyquinolin-2-yl)methyl]morpholin-2-yl]-3-pyridinyl]-6-methylpyridin-2-amine?

The canonical SMILES for N-[6-[(2R)-4-[(8-methoxyquinolin-2-yl)methyl]morpholin-2-yl]-3-pyridinyl]-6-methylpyridin-2-amine is COc1cccc2ccc(CN3CCO[C@@H](c4ccc(Nc5cccc(C)n5)cn4)C3)nc12.

What is the InChIKey of N-[6-[(2R)-4-[(8-methoxyquinolin-2-yl)methyl]morpholin-2-yl]-3-pyridinyl]-6-methylpyridin-2-amine?

The InChIKey is DJMJEWBKAFHALY-XMMPIXPASA-N. The full InChI is InChI=1S/C26H27N5O2/c1-18-5-3-8-25(28-18)29-20-11-12-22(27-15-20)24-17-31(13-14-33-24)16-21-10-9-19-6-4-7-23(32-2)26(19)30-21/h3-12,15,24H,13-14,16-17H2,1-2H3,(H,28,29)/t24-/m1/s1.

What are the key properties of N-[6-[(2R)-4-[(8-methoxyquinolin-2-yl)methyl]morpholin-2-yl]-3-pyridinyl]-6-methylpyridin-2-amine?

N-[6-[(2R)-4-[(8-methoxyquinolin-2-yl)methyl]morpholin-2-yl]-3-pyridinyl]-6-methylpyridin-2-amine has a molecular weight of 441.54 g/mol, XLogP of 4.66, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for N-[6-[(2R)-4-[(8-methoxyquinolin-2-yl)methyl]morpholin-2-yl]-3-pyridinyl]-6-methylpyridin-2-amine is sourced from PubChem (CID 124951705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).