2-(4-methylphenyl)-1,8-naphthyridine-4-carboxylic acid

C16H12N2O2 — CID 70910197

IUPAC2-(4-methylphenyl)-1,8-naphthyridine-4-carboxylic acid
SMILESCc1ccc(-c2cc(C(=O)O)c3cccnc3n2)cc1
InChIInChI=1S/C16H12N2O2/c1-10-4-6-11(7-5-10)14-9-13(16(19)20)12-3-2-8-17-15(12)18-14/h2-9H,1H3,(H,19,20)
InChIKeyYZLADQFMOILKIK-UHFFFAOYSA-N
MW264.28 g/mol
LogP3.30
Rot. Bonds2

About 2-(4-methylphenyl)-1,8-naphthyridine-4-carboxylic acid

2-(4-methylphenyl)-1,8-naphthyridine-4-carboxylic acid (PubChem CID 70910197) has the molecular formula C16H12N2O2 and a molecular weight of 264.28 g/mol. Its IUPAC name is 2-(4-methylphenyl)-1,8-naphthyridine-4-carboxylic acid.

Molecular Properties

Compound Name2-(4-methylphenyl)-1,8-naphthyridine-4-carboxylic acid
PubChem CID70910197
Molecular FormulaC16H12N2O2
Molecular Weight264.28 g/mol
Exact Mass264.09
IUPAC Name2-(4-methylphenyl)-1,8-naphthyridine-4-carboxylic acid
SMILESCc1ccc(-c2cc(C(=O)O)c3cccnc3n2)cc1
InChIInChI=1S/C16H12N2O2/c1-10-4-6-11(7-5-10)14-9-13(16(19)20)12-3-2-8-17-15(12)18-14/h2-9H,1H3,(H,19,20)
InChIKeyYZLADQFMOILKIK-UHFFFAOYSA-N
XLogP3.30
TPSA63.08 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.28
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(2-methylphenyl)ethyl]-2-phenyl-1,8-naphthyridine-4-carboxamide
CID 140502878
2-(3H-dioxol-5-yl)-1,8-naphthyridine-4-carboxylic acid
CID 87890219
ethyl 2-[2-(2,2-dimethylpropanoylamino)-3-pyridinyl]-2-oxoacetate;1-phenylethanone;2-phenyl-1,8-naphthyridine-4-carboxylic acid
CID 159084260
2-(4-ethoxyphenyl)-N-(3-oxopropyl)-1,8-naphthyridine-4-carboxamide
CID 176957412
N-[1-(2,4-dichlorophenyl)ethyl]-2-phenyl-1,8-naphthyridine-4-carboxamide
CID 140502926
2-(4-methylphenyl)-N-pyridin-2-ylquinoline-4-carboxamide
CID 868286
N-benzyl-N-cyclopentyl-2-phenyl-1,8-naphthyridine-4-carboxamide
CID 140502919
4-QUINOLINECARBOXYLIC ACID, 2-PHENYL-, SODIUM SALT (1:1)
CID 167996008
europium;2-phenylquinoline-4-carboxylic acid
CID 87730786
3-(4-methylphenyl)-6-pyridin-3-yl-2H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
CID 126458786
2-(4-carboxyphenyl)quinoline-4-carboxylic acid
CID 57126411
bis(cyclopentane);bis(2-phenylquinoline-4-carboxylic acid);titanium(2+)
CID 135850214

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylphenyl)-1,8-naphthyridine-4-carboxylic acid?
The IUPAC name of 2-(4-methylphenyl)-1,8-naphthyridine-4-carboxylic acid (CID 70910197) is 2-(4-methylphenyl)-1,8-naphthyridine-4-carboxylic acid.
What is the SMILES notation for 2-(4-methylphenyl)-1,8-naphthyridine-4-carboxylic acid?
The canonical SMILES for 2-(4-methylphenyl)-1,8-naphthyridine-4-carboxylic acid is Cc1ccc(-c2cc(C(=O)O)c3cccnc3n2)cc1.
What is the InChIKey of 2-(4-methylphenyl)-1,8-naphthyridine-4-carboxylic acid?
The InChIKey is YZLADQFMOILKIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N2O2/c1-10-4-6-11(7-5-10)14-9-13(16(19)20)12-3-2-8-17-15(12)18-14/h2-9H,1H3,(H,19,20).
What are the key properties of 2-(4-methylphenyl)-1,8-naphthyridine-4-carboxylic acid?
2-(4-methylphenyl)-1,8-naphthyridine-4-carboxylic acid has a molecular weight of 264.28 g/mol, XLogP of 3.30, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylphenyl)-1,8-naphthyridine-4-carboxylic acid is sourced from PubChem (CID 70910197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).