5-[4-(dimethylamino)piperidin-1-yl]-N-(4-methyl-2-oxo-1H-quinolin-6-yl)-2-morpholin-4-ylpyridine-3-carboxamide

C27H34N6O3 — CID 118694872

About 5-[4-(dimethylamino)piperidin-1-yl]-N-(4-methyl-2-oxo-1H-quinolin-6-yl)-2-morpholin-4-ylpyridine-3-carboxamide

5-[4-(dimethylamino)piperidin-1-yl]-N-(4-methyl-2-oxo-1H-quinolin-6-yl)-2-morpholin-4-ylpyridine-3-carboxamide (PubChem CID 118694872) has the molecular formula C27H34N6O3 and a molecular weight of 490.61 g/mol. Its IUPAC name is 5-[4-(dimethylamino)piperidin-1-yl]-N-(4-methyl-2-oxo-1H-quinolin-6-yl)-2-morpholin-4-ylpyridine-3-carboxamide.

Molecular Properties

• Compound Name: 5-[4-(dimethylamino)piperidin-1-yl]-N-(4-methyl-2-oxo-1H-quinolin-6-yl)-2-morpholin-4-ylpyridine-3-carboxamide
• PubChem CID: 118694872
• Molecular Formula: C27H34N6O3
• Molecular Weight: 490.61 g/mol
• Exact Mass: 490.27
• IUPAC Name: 5-[4-(dimethylamino)piperidin-1-yl]-N-(4-methyl-2-oxo-1H-quinolin-6-yl)-2-morpholin-4-ylpyridine-3-carboxamide
• SMILES: Cc1cc(=O)[nH]c2ccc(NC(=O)c3cc(N4CCC(N(C)C)CC4)cnc3N3CCOCC3)cc12
• InChI: InChI=1S/C27H34N6O3/c1-18-14-25(34)30-24-5-4-19(15-22(18)24)29-27(35)23-16-21(32-8-6-20(7-9-32)31(2)3)17-28-26(23)33-10-12-36-13-11-33/h4-5,14-17,20H,6-13H2,1-3H3,(H,29,35)(H,30,34)
• InChIKey: ZPWAHFITISAUCZ-UHFFFAOYSA-N
• XLogP: 2.85
• TPSA: 93.80 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 7
• Rotatable Bonds: 5
• Heavy Atoms: 36
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	490.61
LogP ≤ 5	2.85
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of 5-[4-(dimethylamino)piperidin-1-yl]-N-(4-methyl-2-oxo-1H-quinolin-6-yl)-2-morpholin-4-ylpyridine-3-carboxamide?

The IUPAC name of 5-[4-(dimethylamino)piperidin-1-yl]-N-(4-methyl-2-oxo-1H-quinolin-6-yl)-2-morpholin-4-ylpyridine-3-carboxamide (CID 118694872) is 5-[4-(dimethylamino)piperidin-1-yl]-N-(4-methyl-2-oxo-1H-quinolin-6-yl)-2-morpholin-4-ylpyridine-3-carboxamide.

What is the SMILES notation for 5-[4-(dimethylamino)piperidin-1-yl]-N-(4-methyl-2-oxo-1H-quinolin-6-yl)-2-morpholin-4-ylpyridine-3-carboxamide?

The canonical SMILES for 5-[4-(dimethylamino)piperidin-1-yl]-N-(4-methyl-2-oxo-1H-quinolin-6-yl)-2-morpholin-4-ylpyridine-3-carboxamide is Cc1cc(=O)[nH]c2ccc(NC(=O)c3cc(N4CCC(N(C)C)CC4)cnc3N3CCOCC3)cc12.

What is the InChIKey of 5-[4-(dimethylamino)piperidin-1-yl]-N-(4-methyl-2-oxo-1H-quinolin-6-yl)-2-morpholin-4-ylpyridine-3-carboxamide?

The InChIKey is ZPWAHFITISAUCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H34N6O3/c1-18-14-25(34)30-24-5-4-19(15-22(18)24)29-27(35)23-16-21(32-8-6-20(7-9-32)31(2)3)17-28-26(23)33-10-12-36-13-11-33/h4-5,14-17,20H,6-13H2,1-3H3,(H,29,35)(H,30,34).

What are the key properties of 5-[4-(dimethylamino)piperidin-1-yl]-N-(4-methyl-2-oxo-1H-quinolin-6-yl)-2-morpholin-4-ylpyridine-3-carboxamide?

5-[4-(dimethylamino)piperidin-1-yl]-N-(4-methyl-2-oxo-1H-quinolin-6-yl)-2-morpholin-4-ylpyridine-3-carboxamide has a molecular weight of 490.61 g/mol, XLogP of 2.85, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[4-(dimethylamino)piperidin-1-yl]-N-(4-methyl-2-oxo-1H-quinolin-6-yl)-2-morpholin-4-ylpyridine-3-carboxamide is sourced from PubChem (CID 118694872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).