1-ethyl-7-methyl-4-morpholin-4-yl-2-oxo-1,8-naphthyridine-3-carboxylic acid

C16H19N3O4 — CID 20524630

IUPAC1-ethyl-7-methyl-4-morpholin-4-yl-2-oxo-1,8-naphthyridine-3-carboxylic acid
SMILESCCn1c(=O)c(C(=O)O)c(N2CCOCC2)c2ccc(C)nc21
InChIInChI=1S/C16H19N3O4/c1-3-19-14-11(5-4-10(2)17-14)13(12(15(19)20)16(21)22)18-6-8-23-9-7-18/h4-5H,3,6-9H2,1-2H3,(H,21,22)
InChIKeySKSGXASGONQNKY-UHFFFAOYSA-N
MW317.35 g/mol
LogP1.26
Rot. Bonds3

About 1-ethyl-7-methyl-4-morpholin-4-yl-2-oxo-1,8-naphthyridine-3-carboxylic acid

1-ethyl-7-methyl-4-morpholin-4-yl-2-oxo-1,8-naphthyridine-3-carboxylic acid (PubChem CID 20524630) has the molecular formula C16H19N3O4 and a molecular weight of 317.35 g/mol. Its IUPAC name is 1-ethyl-7-methyl-4-morpholin-4-yl-2-oxo-1,8-naphthyridine-3-carboxylic acid.

Molecular Properties

Compound Name1-ethyl-7-methyl-4-morpholin-4-yl-2-oxo-1,8-naphthyridine-3-carboxylic acid
PubChem CID20524630
Molecular FormulaC16H19N3O4
Molecular Weight317.35 g/mol
Exact Mass317.14
IUPAC Name1-ethyl-7-methyl-4-morpholin-4-yl-2-oxo-1,8-naphthyridine-3-carboxylic acid
SMILESCCn1c(=O)c(C(=O)O)c(N2CCOCC2)c2ccc(C)nc21
InChIInChI=1S/C16H19N3O4/c1-3-19-14-11(5-4-10(2)17-14)13(12(15(19)20)16(21)22)18-6-8-23-9-7-18/h4-5H,3,6-9H2,1-2H3,(H,21,22)
InChIKeySKSGXASGONQNKY-UHFFFAOYSA-N
XLogP1.26
TPSA84.66 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.35
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1,7-dimethyl-4-(4-methylpiperazin-1-yl)-2-oxo-1,8-naphthyridine-3-carboxylic acid
CID 20524642
1-ethyl-7-methyl-2-oxo-4-pyrrolidin-1-yl-1,8-naphthyridine-3-carbonitrile
CID 12818631
1-ethyl-7-methylpyrido[2,3-d][1,3]oxazine-2,4-dione
CID 23349956
1-ethyl-7-methyl-N-(2-morpholin-4-ylethyl)-4-oxo-1,8-naphthyridine-3-carboxamide
CID 4660892
2-(6-ethyl-2,8-dimethyl-5-oxo-3,4-dihydropyrano[3,2-c][1,8]naphthyridin-2-yl)-N-hydroxyacetamide
CID 176903456
2-[7-methyl-3-(morpholine-4-carbonyl)-4-oxo-1,8-naphthyridin-1-yl]-N-phenylacetamide
CID 53087177
3-(1-acetylpiperidin-4-yl)-4-(3-chlorophenyl)-1-ethyl-7-methyl-1,8-naphthyridin-2-one
CID 12991192
2-ethylsulfanyl-4-methyl-6-morpholin-4-ylpyridine-3-carboxylic acid
CID 67287463
1-methyl-4-(4-methylpiperazin-1-yl)-2-oxo-1,8-naphthyridine-3-carboxylic acid
CID 20524636
N-(1-ethyl-5-morpholin-4-yl-6-oxopyridazin-4-yl)-4-methylbenzamide
CID 53200813
10-ethyl-8-methyl-2-piperidin-1-yl-3H-pyrimido[4,5-b][1,8]naphthyridine-4,5-dione
CID 135412907
ethyl 4-morpholin-4-yl-2-oxo-1H-quinoline-3-carboxylate
CID 779668

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-7-methyl-4-morpholin-4-yl-2-oxo-1,8-naphthyridine-3-carboxylic acid?
The IUPAC name of 1-ethyl-7-methyl-4-morpholin-4-yl-2-oxo-1,8-naphthyridine-3-carboxylic acid (CID 20524630) is 1-ethyl-7-methyl-4-morpholin-4-yl-2-oxo-1,8-naphthyridine-3-carboxylic acid.
What is the SMILES notation for 1-ethyl-7-methyl-4-morpholin-4-yl-2-oxo-1,8-naphthyridine-3-carboxylic acid?
The canonical SMILES for 1-ethyl-7-methyl-4-morpholin-4-yl-2-oxo-1,8-naphthyridine-3-carboxylic acid is CCn1c(=O)c(C(=O)O)c(N2CCOCC2)c2ccc(C)nc21.
What is the InChIKey of 1-ethyl-7-methyl-4-morpholin-4-yl-2-oxo-1,8-naphthyridine-3-carboxylic acid?
The InChIKey is SKSGXASGONQNKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O4/c1-3-19-14-11(5-4-10(2)17-14)13(12(15(19)20)16(21)22)18-6-8-23-9-7-18/h4-5H,3,6-9H2,1-2H3,(H,21,22).
What are the key properties of 1-ethyl-7-methyl-4-morpholin-4-yl-2-oxo-1,8-naphthyridine-3-carboxylic acid?
1-ethyl-7-methyl-4-morpholin-4-yl-2-oxo-1,8-naphthyridine-3-carboxylic acid has a molecular weight of 317.35 g/mol, XLogP of 1.26, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-7-methyl-4-morpholin-4-yl-2-oxo-1,8-naphthyridine-3-carboxylic acid is sourced from PubChem (CID 20524630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).