N-[2-[2-methoxyethyl(methyl)amino]ethyl]-6-oxo-1H-pyridine-3-carboxamide

C12H19N3O3 — CID 62850274

IUPACN-[2-[2-methoxyethyl(methyl)amino]ethyl]-6-oxo-1H-pyridine-3-carboxamide
SMILESCOCCN(C)CCNC(=O)c1ccc(=O)[nH]c1
InChIInChI=1S/C12H19N3O3/c1-15(7-8-18-2)6-5-13-12(17)10-3-4-11(16)14-9-10/h3-4,9H,5-8H2,1-2H3,(H,13,17)(H,14,16)
InChIKeyJHDOYSOAWXIBTM-UHFFFAOYSA-N
MW253.30 g/mol
LogP-0.32
Rot. Bonds7

About N-[2-[2-methoxyethyl(methyl)amino]ethyl]-6-oxo-1H-pyridine-3-carboxamide

N-[2-[2-methoxyethyl(methyl)amino]ethyl]-6-oxo-1H-pyridine-3-carboxamide (PubChem CID 62850274) has the molecular formula C12H19N3O3 and a molecular weight of 253.30 g/mol. Its IUPAC name is N-[2-[2-methoxyethyl(methyl)amino]ethyl]-6-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[2-[2-methoxyethyl(methyl)amino]ethyl]-6-oxo-1H-pyridine-3-carboxamide
PubChem CID62850274
Molecular FormulaC12H19N3O3
Molecular Weight253.30 g/mol
Exact Mass253.14
IUPAC NameN-[2-[2-methoxyethyl(methyl)amino]ethyl]-6-oxo-1H-pyridine-3-carboxamide
SMILESCOCCN(C)CCNC(=O)c1ccc(=O)[nH]c1
InChIInChI=1S/C12H19N3O3/c1-15(7-8-18-2)6-5-13-12(17)10-3-4-11(16)14-9-10/h3-4,9H,5-8H2,1-2H3,(H,13,17)(H,14,16)
InChIKeyJHDOYSOAWXIBTM-UHFFFAOYSA-N
XLogP-0.32
TPSA74.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.30
LogP ≤ 5-0.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[2-[2-methoxyethyl(methyl)amino]ethylcarbamoyl]benzoic acid
CID 62850824
N-(3-hydroxy-4-methoxybutyl)-6-oxo-1H-pyridine-3-carboxamide
CID 103877366
3-hydroxy-N-[2-[2-methoxyethyl(methyl)amino]ethyl]-4-methylbenzamide
CID 62849743
3-amino-4-(dimethylamino)-N-[2-[2-methoxyethyl(methyl)amino]ethyl]benzamide
CID 62842877
N-(2-hydroxyethyl)-6-oxo-1H-pyridine-3-carboxamide
CID 43389064
2-(4-carbamothioylphenyl)-N-[2-[2-methoxyethyl(methyl)amino]ethyl]acetamide
CID 63611510
3-amino-N-[2-[2-methoxyethyl(methyl)amino]ethyl]benzamide;dihydrochloride
CID 119871098
4-amino-3-fluoro-N-[2-[2-methoxyethyl(methyl)amino]ethyl]benzamide
CID 62844638
3-amino-4-bromo-N-[2-[2-methoxyethyl(methyl)amino]ethyl]benzamide
CID 55126476
4-amino-3-methoxy-N-[2-[2-methoxyethyl(methyl)amino]ethyl]benzamide
CID 104782871
4-hydrazinyl-N-[2-[2-methoxyethyl(methyl)amino]ethyl]-3-methylbenzamide
CID 63212418
N-(4-methoxybutan-2-yl)-6-oxo-1H-pyridine-3-carboxamide
CID 62612412

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-methoxyethyl(methyl)amino]ethyl]-6-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-[2-[2-methoxyethyl(methyl)amino]ethyl]-6-oxo-1H-pyridine-3-carboxamide (CID 62850274) is N-[2-[2-methoxyethyl(methyl)amino]ethyl]-6-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-[2-[2-methoxyethyl(methyl)amino]ethyl]-6-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-[2-[2-methoxyethyl(methyl)amino]ethyl]-6-oxo-1H-pyridine-3-carboxamide is COCCN(C)CCNC(=O)c1ccc(=O)[nH]c1.
What is the InChIKey of N-[2-[2-methoxyethyl(methyl)amino]ethyl]-6-oxo-1H-pyridine-3-carboxamide?
The InChIKey is JHDOYSOAWXIBTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O3/c1-15(7-8-18-2)6-5-13-12(17)10-3-4-11(16)14-9-10/h3-4,9H,5-8H2,1-2H3,(H,13,17)(H,14,16).
What are the key properties of N-[2-[2-methoxyethyl(methyl)amino]ethyl]-6-oxo-1H-pyridine-3-carboxamide?
N-[2-[2-methoxyethyl(methyl)amino]ethyl]-6-oxo-1H-pyridine-3-carboxamide has a molecular weight of 253.30 g/mol, XLogP of -0.32, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-methoxyethyl(methyl)amino]ethyl]-6-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 62850274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).