N-(2-methoxyethyl)-2-oxo-1H-1,5-naphthyridine-3-carboxamide

C12H13N3O3 — CID 141129422

IUPACN-(2-methoxyethyl)-2-oxo-1H-1,5-naphthyridine-3-carboxamide
SMILESCOCCNC(=O)c1cc2ncccc2[nH]c1=O
InChIInChI=1S/C12H13N3O3/c1-18-6-5-14-11(16)8-7-10-9(15-12(8)17)3-2-4-13-10/h2-4,7H,5-6H2,1H3,(H,14,16)(H,15,17)
InChIKeySTLMMGSGVFSUPD-UHFFFAOYSA-N
MW247.25 g/mol
LogP0.30
Rot. Bonds4

About N-(2-methoxyethyl)-2-oxo-1H-1,5-naphthyridine-3-carboxamide

N-(2-methoxyethyl)-2-oxo-1H-1,5-naphthyridine-3-carboxamide (PubChem CID 141129422) has the molecular formula C12H13N3O3 and a molecular weight of 247.25 g/mol. Its IUPAC name is N-(2-methoxyethyl)-2-oxo-1H-1,5-naphthyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-2-oxo-1H-1,5-naphthyridine-3-carboxamide
PubChem CID141129422
Molecular FormulaC12H13N3O3
Molecular Weight247.25 g/mol
Exact Mass247.10
IUPAC NameN-(2-methoxyethyl)-2-oxo-1H-1,5-naphthyridine-3-carboxamide
SMILESCOCCNC(=O)c1cc2ncccc2[nH]c1=O
InChIInChI=1S/C12H13N3O3/c1-18-6-5-14-11(16)8-7-10-9(15-12(8)17)3-2-4-13-10/h2-4,7H,5-6H2,1H3,(H,14,16)(H,15,17)
InChIKeySTLMMGSGVFSUPD-UHFFFAOYSA-N
XLogP0.30
TPSA84.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.25
LogP ≤ 50.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(2-methoxyethyl)-2-oxo-6-pyridin-4-yl-1H-pyridine-3-carboxamide
CID 129352938
5-bromo-N-(2-methoxyethyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 129393787
5-iodo-N-(2-methoxyethyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 125491246
3-fluoro-N-(2-methoxyethyl)pyridine-2-carboxamide
CID 110474737
1-N,2-N-bis(2-methoxyethyl)benzene-1,2-dicarboxamide
CID 4574574
5-bromo-6-ethyl-N-(2-methoxyethyl)-2-oxo-1H-pyridine-3-carboxamide
CID 125491067
6-methoxy-N-(2-methoxyethyl)quinoline-8-carboxamide
CID 175792430
6-bromo-N-(4-methoxybutyl)-2-oxo-1H-quinoline-3-carboxamide
CID 110416375
3-amino-N-(2-methoxyethyl)pyridine-2-carboxamide
CID 104740778
N-(3-methoxypropyl)quinoline-5-carboxamide
CID 51075711
N-(2-methoxyethyl)-2-quinolin-6-yloxyacetamide
CID 47453984
N-(2-methoxyethyl)-2,5-dioxo-1,6,7,8-tetrahydroquinoline-3-carboxamide
CID 36656888

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-2-oxo-1H-1,5-naphthyridine-3-carboxamide?
The IUPAC name of N-(2-methoxyethyl)-2-oxo-1H-1,5-naphthyridine-3-carboxamide (CID 141129422) is N-(2-methoxyethyl)-2-oxo-1H-1,5-naphthyridine-3-carboxamide.
What is the SMILES notation for N-(2-methoxyethyl)-2-oxo-1H-1,5-naphthyridine-3-carboxamide?
The canonical SMILES for N-(2-methoxyethyl)-2-oxo-1H-1,5-naphthyridine-3-carboxamide is COCCNC(=O)c1cc2ncccc2[nH]c1=O.
What is the InChIKey of N-(2-methoxyethyl)-2-oxo-1H-1,5-naphthyridine-3-carboxamide?
The InChIKey is STLMMGSGVFSUPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O3/c1-18-6-5-14-11(16)8-7-10-9(15-12(8)17)3-2-4-13-10/h2-4,7H,5-6H2,1H3,(H,14,16)(H,15,17).
What are the key properties of N-(2-methoxyethyl)-2-oxo-1H-1,5-naphthyridine-3-carboxamide?
N-(2-methoxyethyl)-2-oxo-1H-1,5-naphthyridine-3-carboxamide has a molecular weight of 247.25 g/mol, XLogP of 0.30, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-2-oxo-1H-1,5-naphthyridine-3-carboxamide is sourced from PubChem (CID 141129422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).