6-ethoxy-4-[(6-ethoxy-2-pyridinyl)amino]-7-methyl-1,8-naphthyridine-3-carboxylic acid

C19H20N4O4 — CID 23209180

IUPAC6-ethoxy-4-[(6-ethoxy-2-pyridinyl)amino]-7-methyl-1,8-naphthyridine-3-carboxylic acid
SMILESCCOc1cccc(Nc2c(C(=O)O)cnc3nc(C)c(OCC)cc23)n1
InChIInChI=1S/C19H20N4O4/c1-4-26-14-9-12-17(23-15-7-6-8-16(22-15)27-5-2)13(19(24)25)10-20-18(12)21-11(14)3/h6-10H,4-5H2,1-3H3,(H,24,25)(H,20,21,22,23)
InChIKeySYCWEZIFQKHXLS-UHFFFAOYSA-N
MW368.39 g/mol
LogP3.57
Rot. Bonds7

About 6-ethoxy-4-[(6-ethoxy-2-pyridinyl)amino]-7-methyl-1,8-naphthyridine-3-carboxylic acid

6-ethoxy-4-[(6-ethoxy-2-pyridinyl)amino]-7-methyl-1,8-naphthyridine-3-carboxylic acid (PubChem CID 23209180) has the molecular formula C19H20N4O4 and a molecular weight of 368.39 g/mol. Its IUPAC name is 6-ethoxy-4-[(6-ethoxy-2-pyridinyl)amino]-7-methyl-1,8-naphthyridine-3-carboxylic acid.

Molecular Properties

Compound Name6-ethoxy-4-[(6-ethoxy-2-pyridinyl)amino]-7-methyl-1,8-naphthyridine-3-carboxylic acid
PubChem CID23209180
Molecular FormulaC19H20N4O4
Molecular Weight368.39 g/mol
Exact Mass368.15
IUPAC Name6-ethoxy-4-[(6-ethoxy-2-pyridinyl)amino]-7-methyl-1,8-naphthyridine-3-carboxylic acid
SMILESCCOc1cccc(Nc2c(C(=O)O)cnc3nc(C)c(OCC)cc23)n1
InChIInChI=1S/C19H20N4O4/c1-4-26-14-9-12-17(23-15-7-6-8-16(22-15)27-5-2)13(19(24)25)10-20-18(12)21-11(14)3/h6-10H,4-5H2,1-3H3,(H,24,25)(H,20,21,22,23)
InChIKeySYCWEZIFQKHXLS-UHFFFAOYSA-N
XLogP3.57
TPSA106.46 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.39
LogP ≤ 53.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-ethoxy-4-[(6-ethoxy-2-pyridinyl)amino]-7-methyl-1,8-naphthyridine-3-carboxylic acid?
The IUPAC name of 6-ethoxy-4-[(6-ethoxy-2-pyridinyl)amino]-7-methyl-1,8-naphthyridine-3-carboxylic acid (CID 23209180) is 6-ethoxy-4-[(6-ethoxy-2-pyridinyl)amino]-7-methyl-1,8-naphthyridine-3-carboxylic acid.
What is the SMILES notation for 6-ethoxy-4-[(6-ethoxy-2-pyridinyl)amino]-7-methyl-1,8-naphthyridine-3-carboxylic acid?
The canonical SMILES for 6-ethoxy-4-[(6-ethoxy-2-pyridinyl)amino]-7-methyl-1,8-naphthyridine-3-carboxylic acid is CCOc1cccc(Nc2c(C(=O)O)cnc3nc(C)c(OCC)cc23)n1.
What is the InChIKey of 6-ethoxy-4-[(6-ethoxy-2-pyridinyl)amino]-7-methyl-1,8-naphthyridine-3-carboxylic acid?
The InChIKey is SYCWEZIFQKHXLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O4/c1-4-26-14-9-12-17(23-15-7-6-8-16(22-15)27-5-2)13(19(24)25)10-20-18(12)21-11(14)3/h6-10H,4-5H2,1-3H3,(H,24,25)(H,20,21,22,23).
What are the key properties of 6-ethoxy-4-[(6-ethoxy-2-pyridinyl)amino]-7-methyl-1,8-naphthyridine-3-carboxylic acid?
6-ethoxy-4-[(6-ethoxy-2-pyridinyl)amino]-7-methyl-1,8-naphthyridine-3-carboxylic acid has a molecular weight of 368.39 g/mol, XLogP of 3.57, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethoxy-4-[(6-ethoxy-2-pyridinyl)amino]-7-methyl-1,8-naphthyridine-3-carboxylic acid is sourced from PubChem (CID 23209180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).