1-ethyl-N-(furan-2-ylmethyl)-7-methyl-4-oxo-1,8-naphthyridine-3-carboxamide

C17H17N3O3 — CID 859261

IUPAC1-ethyl-N-(furan-2-ylmethyl)-7-methyl-4-oxo-1,8-naphthyridine-3-carboxamide
SMILESCCn1cc(C(=O)NCc2ccco2)c(=O)c2ccc(C)nc21
InChIInChI=1S/C17H17N3O3/c1-3-20-10-14(17(22)18-9-12-5-4-8-23-12)15(21)13-7-6-11(2)19-16(13)20/h4-8,10H,3,9H2,1-2H3,(H,18,22)
InChIKeyGSEVAABIJDQZMF-UHFFFAOYSA-N
MW311.34 g/mol
LogP2.25
Rot. Bonds4

About 1-ethyl-N-(furan-2-ylmethyl)-7-methyl-4-oxo-1,8-naphthyridine-3-carboxamide

1-ethyl-N-(furan-2-ylmethyl)-7-methyl-4-oxo-1,8-naphthyridine-3-carboxamide (PubChem CID 859261) has the molecular formula C17H17N3O3 and a molecular weight of 311.34 g/mol. Its IUPAC name is 1-ethyl-N-(furan-2-ylmethyl)-7-methyl-4-oxo-1,8-naphthyridine-3-carboxamide.

Molecular Properties

Compound Name1-ethyl-N-(furan-2-ylmethyl)-7-methyl-4-oxo-1,8-naphthyridine-3-carboxamide
PubChem CID859261
Molecular FormulaC17H17N3O3
Molecular Weight311.34 g/mol
Exact Mass311.13
IUPAC Name1-ethyl-N-(furan-2-ylmethyl)-7-methyl-4-oxo-1,8-naphthyridine-3-carboxamide
SMILESCCn1cc(C(=O)NCc2ccco2)c(=O)c2ccc(C)nc21
InChIInChI=1S/C17H17N3O3/c1-3-20-10-14(17(22)18-9-12-5-4-8-23-12)15(21)13-7-6-11(2)19-16(13)20/h4-8,10H,3,9H2,1-2H3,(H,18,22)
InChIKeyGSEVAABIJDQZMF-UHFFFAOYSA-N
XLogP2.25
TPSA77.13 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.34
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-(furan-2-yl)-3,4''-bipyridin-6-yl)acetamide
CID 46880333
6-{[(3s,4s)-4-{2-[(Furan-2-Ylmethyl)amino]ethoxy}pyrrolidin-3-Yl]methyl}-4-Methylpyridin-2-Amine
CID 56835764
Dipyridodiazepinone deriv. 39
CID 463559
N-(2-(furan-2-yl)-3,4''-bipyridin-6-yl)cyclopropanecarboxamide
CID 46866591
N-[2-(pyridin-2-ylcarbamoyl)phenyl]furan-2-carboxamide
CID 722974
(5Z)-5-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylidene]-3-(furan-2-ylmethyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
CID 1616902
N-[4-[(4-methylpyridin-2-yl)carbamoyl]phenyl]furan-2-carboxamide
CID 1262407
N-[6-(2-Furanyl)-5-(4-pyridinyl)-2-pyrazinyl]acetamide
CID 16072019
n-[6-(2-Furyl)-5-pyridin-4-ylpyrazin-2-yl]propanamide
CID 16072020
n-[6-(2-Furyl)-5-pyridin-4-ylpyrazin-2-yl]-2-methylpropanamide
CID 16072023
4-amino-2-(furan-2-yl)-N-[(3-methyl-2-pyridinyl)methyl]pyrimidine-5-carboxamide
CID 142609112
1-(2-Furylmethyl)-2-imino-10-methyl-5-oxo-N-(3-pyridinylmethyl)-1,5-dihydro-2H-dipyrido[1,2-A:2,3-D]pyrimidine-3-carboxamide
CID 1524115

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-(furan-2-ylmethyl)-7-methyl-4-oxo-1,8-naphthyridine-3-carboxamide?
The IUPAC name of 1-ethyl-N-(furan-2-ylmethyl)-7-methyl-4-oxo-1,8-naphthyridine-3-carboxamide (CID 859261) is 1-ethyl-N-(furan-2-ylmethyl)-7-methyl-4-oxo-1,8-naphthyridine-3-carboxamide.
What is the SMILES notation for 1-ethyl-N-(furan-2-ylmethyl)-7-methyl-4-oxo-1,8-naphthyridine-3-carboxamide?
The canonical SMILES for 1-ethyl-N-(furan-2-ylmethyl)-7-methyl-4-oxo-1,8-naphthyridine-3-carboxamide is CCn1cc(C(=O)NCc2ccco2)c(=O)c2ccc(C)nc21.
What is the InChIKey of 1-ethyl-N-(furan-2-ylmethyl)-7-methyl-4-oxo-1,8-naphthyridine-3-carboxamide?
The InChIKey is GSEVAABIJDQZMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O3/c1-3-20-10-14(17(22)18-9-12-5-4-8-23-12)15(21)13-7-6-11(2)19-16(13)20/h4-8,10H,3,9H2,1-2H3,(H,18,22).
What are the key properties of 1-ethyl-N-(furan-2-ylmethyl)-7-methyl-4-oxo-1,8-naphthyridine-3-carboxamide?
1-ethyl-N-(furan-2-ylmethyl)-7-methyl-4-oxo-1,8-naphthyridine-3-carboxamide has a molecular weight of 311.34 g/mol, XLogP of 2.25, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-(furan-2-ylmethyl)-7-methyl-4-oxo-1,8-naphthyridine-3-carboxamide is sourced from PubChem (CID 859261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).