1-(2-methoxyethyl)-6-methyl-N-[(6-morpholin-4-yl-2-pyridinyl)methyl]-4-oxopyridine-3-carboxamide

C20H26N4O4 — CID 167887604

IUPAC1-(2-methoxyethyl)-6-methyl-N-[(6-morpholin-4-yl-2-pyridinyl)methyl]-4-oxopyridine-3-carboxamide
SMILESCOCCn1cc(C(=O)NCc2cccc(N3CCOCC3)n2)c(=O)cc1C
InChIInChI=1S/C20H26N4O4/c1-15-12-18(25)17(14-24(15)6-9-27-2)20(26)21-13-16-4-3-5-19(22-16)23-7-10-28-11-8-23/h3-5,12,14H,6-11,13H2,1-2H3,(H,21,26)
InChIKeyANORQLUCAXOQPG-UHFFFAOYSA-N
MW386.45 g/mol
LogP0.96
Rot. Bonds7

About 1-(2-methoxyethyl)-6-methyl-N-[(6-morpholin-4-yl-2-pyridinyl)methyl]-4-oxopyridine-3-carboxamide

1-(2-methoxyethyl)-6-methyl-N-[(6-morpholin-4-yl-2-pyridinyl)methyl]-4-oxopyridine-3-carboxamide (PubChem CID 167887604) has the molecular formula C20H26N4O4 and a molecular weight of 386.45 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-6-methyl-N-[(6-morpholin-4-yl-2-pyridinyl)methyl]-4-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name1-(2-methoxyethyl)-6-methyl-N-[(6-morpholin-4-yl-2-pyridinyl)methyl]-4-oxopyridine-3-carboxamide
PubChem CID167887604
Molecular FormulaC20H26N4O4
Molecular Weight386.45 g/mol
Exact Mass386.20
IUPAC Name1-(2-methoxyethyl)-6-methyl-N-[(6-morpholin-4-yl-2-pyridinyl)methyl]-4-oxopyridine-3-carboxamide
SMILESCOCCn1cc(C(=O)NCc2cccc(N3CCOCC3)n2)c(=O)cc1C
InChIInChI=1S/C20H26N4O4/c1-15-12-18(25)17(14-24(15)6-9-27-2)20(26)21-13-16-4-3-5-19(22-16)23-7-10-28-11-8-23/h3-5,12,14H,6-11,13H2,1-2H3,(H,21,26)
InChIKeyANORQLUCAXOQPG-UHFFFAOYSA-N
XLogP0.96
TPSA85.69 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.45
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-6-methyl-N-[(6-morpholin-4-yl-2-pyridinyl)methyl]-4-oxopyridine-3-carboxamide?
The IUPAC name of 1-(2-methoxyethyl)-6-methyl-N-[(6-morpholin-4-yl-2-pyridinyl)methyl]-4-oxopyridine-3-carboxamide (CID 167887604) is 1-(2-methoxyethyl)-6-methyl-N-[(6-morpholin-4-yl-2-pyridinyl)methyl]-4-oxopyridine-3-carboxamide.
What is the SMILES notation for 1-(2-methoxyethyl)-6-methyl-N-[(6-morpholin-4-yl-2-pyridinyl)methyl]-4-oxopyridine-3-carboxamide?
The canonical SMILES for 1-(2-methoxyethyl)-6-methyl-N-[(6-morpholin-4-yl-2-pyridinyl)methyl]-4-oxopyridine-3-carboxamide is COCCn1cc(C(=O)NCc2cccc(N3CCOCC3)n2)c(=O)cc1C.
What is the InChIKey of 1-(2-methoxyethyl)-6-methyl-N-[(6-morpholin-4-yl-2-pyridinyl)methyl]-4-oxopyridine-3-carboxamide?
The InChIKey is ANORQLUCAXOQPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O4/c1-15-12-18(25)17(14-24(15)6-9-27-2)20(26)21-13-16-4-3-5-19(22-16)23-7-10-28-11-8-23/h3-5,12,14H,6-11,13H2,1-2H3,(H,21,26).
What are the key properties of 1-(2-methoxyethyl)-6-methyl-N-[(6-morpholin-4-yl-2-pyridinyl)methyl]-4-oxopyridine-3-carboxamide?
1-(2-methoxyethyl)-6-methyl-N-[(6-morpholin-4-yl-2-pyridinyl)methyl]-4-oxopyridine-3-carboxamide has a molecular weight of 386.45 g/mol, XLogP of 0.96, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-6-methyl-N-[(6-morpholin-4-yl-2-pyridinyl)methyl]-4-oxopyridine-3-carboxamide is sourced from PubChem (CID 167887604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).