7-(methoxymethyl)-3,4-dihydro-1H-2,6-naphthyridine-2-carboxylic acid

C11H14N2O3 — CID 146273702

IUPAC7-(methoxymethyl)-3,4-dihydro-1H-2,6-naphthyridine-2-carboxylic acid
SMILESCOCc1cc2c(cn1)CCN(C(=O)O)C2
InChIInChI=1S/C11H14N2O3/c1-16-7-10-4-9-6-13(11(14)15)3-2-8(9)5-12-10/h4-5H,2-3,6-7H2,1H3,(H,14,15)
InChIKeyZNQDGEZXBAAVFJ-UHFFFAOYSA-N
MW222.24 g/mol
LogP1.26
Rot. Bonds2

About 7-(methoxymethyl)-3,4-dihydro-1H-2,6-naphthyridine-2-carboxylic acid

7-(methoxymethyl)-3,4-dihydro-1H-2,6-naphthyridine-2-carboxylic acid (PubChem CID 146273702) has the molecular formula C11H14N2O3 and a molecular weight of 222.24 g/mol. Its IUPAC name is 7-(methoxymethyl)-3,4-dihydro-1H-2,6-naphthyridine-2-carboxylic acid.

Molecular Properties

Compound Name7-(methoxymethyl)-3,4-dihydro-1H-2,6-naphthyridine-2-carboxylic acid
PubChem CID146273702
Molecular FormulaC11H14N2O3
Molecular Weight222.24 g/mol
Exact Mass222.10
IUPAC Name7-(methoxymethyl)-3,4-dihydro-1H-2,6-naphthyridine-2-carboxylic acid
SMILESCOCc1cc2c(cn1)CCN(C(=O)O)C2
InChIInChI=1S/C11H14N2O3/c1-16-7-10-4-9-6-13(11(14)15)3-2-8(9)5-12-10/h4-5H,2-3,6-7H2,1H3,(H,14,15)
InChIKeyZNQDGEZXBAAVFJ-UHFFFAOYSA-N
XLogP1.26
TPSA62.66 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.24
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-(methoxymethyl)-3,4-dihydro-1H-2,6-naphthyridine-2-carboxylic acid?
The IUPAC name of 7-(methoxymethyl)-3,4-dihydro-1H-2,6-naphthyridine-2-carboxylic acid (CID 146273702) is 7-(methoxymethyl)-3,4-dihydro-1H-2,6-naphthyridine-2-carboxylic acid.
What is the SMILES notation for 7-(methoxymethyl)-3,4-dihydro-1H-2,6-naphthyridine-2-carboxylic acid?
The canonical SMILES for 7-(methoxymethyl)-3,4-dihydro-1H-2,6-naphthyridine-2-carboxylic acid is COCc1cc2c(cn1)CCN(C(=O)O)C2.
What is the InChIKey of 7-(methoxymethyl)-3,4-dihydro-1H-2,6-naphthyridine-2-carboxylic acid?
The InChIKey is ZNQDGEZXBAAVFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O3/c1-16-7-10-4-9-6-13(11(14)15)3-2-8(9)5-12-10/h4-5H,2-3,6-7H2,1H3,(H,14,15).
What are the key properties of 7-(methoxymethyl)-3,4-dihydro-1H-2,6-naphthyridine-2-carboxylic acid?
7-(methoxymethyl)-3,4-dihydro-1H-2,6-naphthyridine-2-carboxylic acid has a molecular weight of 222.24 g/mol, XLogP of 1.26, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(methoxymethyl)-3,4-dihydro-1H-2,6-naphthyridine-2-carboxylic acid is sourced from PubChem (CID 146273702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).