N-(3,4-dimethoxyphenyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide

C19H19N3O4 — CID 7619926

IUPACN-(3,4-dimethoxyphenyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide
SMILESCCn1c(=O)c(C(=O)Nc2ccc(OC)c(OC)c2)cc2cccnc21
InChIInChI=1S/C19H19N3O4/c1-4-22-17-12(6-5-9-20-17)10-14(19(22)24)18(23)21-13-7-8-15(25-2)16(11-13)26-3/h5-11H,4H2,1-3H3,(H,21,23)
InChIKeyFJDDEGKJVQNTRL-UHFFFAOYSA-N
MW353.38 g/mol
LogP2.69
Rot. Bonds5

About N-(3,4-dimethoxyphenyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide

N-(3,4-dimethoxyphenyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide (PubChem CID 7619926) has the molecular formula C19H19N3O4 and a molecular weight of 353.38 g/mol. Its IUPAC name is N-(3,4-dimethoxyphenyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3,4-dimethoxyphenyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide
PubChem CID7619926
Molecular FormulaC19H19N3O4
Molecular Weight353.38 g/mol
Exact Mass353.14
IUPAC NameN-(3,4-dimethoxyphenyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide
SMILESCCn1c(=O)c(C(=O)Nc2ccc(OC)c(OC)c2)cc2cccnc21
InChIInChI=1S/C19H19N3O4/c1-4-22-17-12(6-5-9-20-17)10-14(19(22)24)18(23)21-13-7-8-15(25-2)16(11-13)26-3/h5-11H,4H2,1-3H3,(H,21,23)
InChIKeyFJDDEGKJVQNTRL-UHFFFAOYSA-N
XLogP2.69
TPSA82.45 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.38
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethoxyphenyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide?
The IUPAC name of N-(3,4-dimethoxyphenyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide (CID 7619926) is N-(3,4-dimethoxyphenyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide.
What is the SMILES notation for N-(3,4-dimethoxyphenyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide?
The canonical SMILES for N-(3,4-dimethoxyphenyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide is CCn1c(=O)c(C(=O)Nc2ccc(OC)c(OC)c2)cc2cccnc21.
What is the InChIKey of N-(3,4-dimethoxyphenyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide?
The InChIKey is FJDDEGKJVQNTRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O4/c1-4-22-17-12(6-5-9-20-17)10-14(19(22)24)18(23)21-13-7-8-15(25-2)16(11-13)26-3/h5-11H,4H2,1-3H3,(H,21,23).
What are the key properties of N-(3,4-dimethoxyphenyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide?
N-(3,4-dimethoxyphenyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide has a molecular weight of 353.38 g/mol, XLogP of 2.69, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethoxyphenyl)-1-ethyl-2-oxo-1,8-naphthyridine-3-carboxamide is sourced from PubChem (CID 7619926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).