2-amino-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]butanamide

C12H19N3O3 — CID 43713286

IUPAC2-amino-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]butanamide
SMILESCCC(N)C(=O)Nc1ccc(=O)n(CCOC)c1
InChIInChI=1S/C12H19N3O3/c1-3-10(13)12(17)14-9-4-5-11(16)15(8-9)6-7-18-2/h4-5,8,10H,3,6-7,13H2,1-2H3,(H,14,17)
InChIKeyXKJYKPMYYUQHHS-UHFFFAOYSA-N
MW253.30 g/mol
LogP0.17
Rot. Bonds6

About 2-amino-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]butanamide

2-amino-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]butanamide (PubChem CID 43713286) has the molecular formula C12H19N3O3 and a molecular weight of 253.30 g/mol. Its IUPAC name is 2-amino-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]butanamide.

Molecular Properties

Compound Name2-amino-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]butanamide
PubChem CID43713286
Molecular FormulaC12H19N3O3
Molecular Weight253.30 g/mol
Exact Mass253.14
IUPAC Name2-amino-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]butanamide
SMILESCCC(N)C(=O)Nc1ccc(=O)n(CCOC)c1
InChIInChI=1S/C12H19N3O3/c1-3-10(13)12(17)14-9-4-5-11(16)15(8-9)6-7-18-2/h4-5,8,10H,3,6-7,13H2,1-2H3,(H,14,17)
InChIKeyXKJYKPMYYUQHHS-UHFFFAOYSA-N
XLogP0.17
TPSA86.35 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.30
LogP ≤ 50.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-4-methoxy-N-(6-oxo-1-propyl-3-pyridinyl)butanamide
CID 62473033
(2S)-2-amino-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]-4-methylsulfanylbutanamide
CID 61179548
2-bromo-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]propanamide
CID 107903976
N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]-2-methyl-3-(methylamino)propanamide
CID 79196697
(2S)-2-amino-N-(1-methyl-6-oxo-3-pyridinyl)butanamide
CID 79024286
2-amino-4-methyl-N-(6-oxo-1-propyl-3-pyridinyl)pentanamide
CID 54862542
N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]-3-methylbut-2-enamide
CID 113222064
2-(2-methoxyethylamino)-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]acetamide
CID 79281498
2,2,3,3-tetrafluoro-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]propanamide
CID 103776757
3-chloro-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]-2,2-dimethylpropanamide
CID 63680566
N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]imidazole-1-carboxamide
CID 81257251
(2S)-2-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-3-methylpentanamide
CID 61172675

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]butanamide?
The IUPAC name of 2-amino-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]butanamide (CID 43713286) is 2-amino-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]butanamide.
What is the SMILES notation for 2-amino-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]butanamide?
The canonical SMILES for 2-amino-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]butanamide is CCC(N)C(=O)Nc1ccc(=O)n(CCOC)c1.
What is the InChIKey of 2-amino-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]butanamide?
The InChIKey is XKJYKPMYYUQHHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O3/c1-3-10(13)12(17)14-9-4-5-11(16)15(8-9)6-7-18-2/h4-5,8,10H,3,6-7,13H2,1-2H3,(H,14,17).
What are the key properties of 2-amino-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]butanamide?
2-amino-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]butanamide has a molecular weight of 253.30 g/mol, XLogP of 0.17, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]butanamide is sourced from PubChem (CID 43713286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).