2-[6-(dimethylamino)-3-pyridinyl]-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-ethyl-8-propan-2-yl-7H-1,8-naphthyridine-4-carboxamide

C29H36N6O2 — CID 123885174

About 2-[6-(dimethylamino)-3-pyridinyl]-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-ethyl-8-propan-2-yl-7H-1,8-naphthyridine-4-carboxamide

2-[6-(dimethylamino)-3-pyridinyl]-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-ethyl-8-propan-2-yl-7H-1,8-naphthyridine-4-carboxamide (PubChem CID 123885174) has the molecular formula C29H36N6O2 and a molecular weight of 500.65 g/mol. Its IUPAC name is 2-[6-(dimethylamino)-3-pyridinyl]-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-ethyl-8-propan-2-yl-7H-1,8-naphthyridine-4-carboxamide.

Molecular Properties

• Compound Name: 2-[6-(dimethylamino)-3-pyridinyl]-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-ethyl-8-propan-2-yl-7H-1,8-naphthyridine-4-carboxamide
• PubChem CID: 123885174
• Molecular Formula: C29H36N6O2
• Molecular Weight: 500.65 g/mol
• Exact Mass: 500.29
• IUPAC Name: 2-[6-(dimethylamino)-3-pyridinyl]-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-ethyl-8-propan-2-yl-7H-1,8-naphthyridine-4-carboxamide
• SMILES: CCC1=Cc2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(-c3ccc(N(C)C)nc3)nc2N(C(C)C)C1
• InChI: InChI=1S/C29H36N6O2/c1-8-20-12-22-23(28(36)31-15-24-18(4)11-19(5)32-29(24)37)13-25(33-27(22)35(16-20)17(2)3)21-9-10-26(30-14-21)34(6)7/h9-14,17H,8,15-16H2,1-7H3,(H,31,36)(H,32,37)
• InChIKey: XXJNOPVNDCQIIZ-UHFFFAOYSA-N
• XLogP: 4.47
• TPSA: 94.22 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 6
• Rotatable Bonds: 7
• Heavy Atoms: 37
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	500.65
LogP ≤ 5	4.47
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 2-[6-(dimethylamino)-3-pyridinyl]-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-ethyl-8-propan-2-yl-7H-1,8-naphthyridine-4-carboxamide?

The IUPAC name of 2-[6-(dimethylamino)-3-pyridinyl]-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-ethyl-8-propan-2-yl-7H-1,8-naphthyridine-4-carboxamide (CID 123885174) is 2-[6-(dimethylamino)-3-pyridinyl]-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-ethyl-8-propan-2-yl-7H-1,8-naphthyridine-4-carboxamide.

What is the SMILES notation for 2-[6-(dimethylamino)-3-pyridinyl]-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-ethyl-8-propan-2-yl-7H-1,8-naphthyridine-4-carboxamide?

The canonical SMILES for 2-[6-(dimethylamino)-3-pyridinyl]-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-ethyl-8-propan-2-yl-7H-1,8-naphthyridine-4-carboxamide is CCC1=Cc2c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(-c3ccc(N(C)C)nc3)nc2N(C(C)C)C1.

What is the InChIKey of 2-[6-(dimethylamino)-3-pyridinyl]-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-ethyl-8-propan-2-yl-7H-1,8-naphthyridine-4-carboxamide?

The InChIKey is XXJNOPVNDCQIIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H36N6O2/c1-8-20-12-22-23(28(36)31-15-24-18(4)11-19(5)32-29(24)37)13-25(33-27(22)35(16-20)17(2)3)21-9-10-26(30-14-21)34(6)7/h9-14,17H,8,15-16H2,1-7H3,(H,31,36)(H,32,37).

What are the key properties of 2-[6-(dimethylamino)-3-pyridinyl]-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-ethyl-8-propan-2-yl-7H-1,8-naphthyridine-4-carboxamide?

2-[6-(dimethylamino)-3-pyridinyl]-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-ethyl-8-propan-2-yl-7H-1,8-naphthyridine-4-carboxamide has a molecular weight of 500.65 g/mol, XLogP of 4.47, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[6-(dimethylamino)-3-pyridinyl]-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-6-ethyl-8-propan-2-yl-7H-1,8-naphthyridine-4-carboxamide is sourced from PubChem (CID 123885174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).