4-hydroxy-6-methoxynaphthalene-2-carboxylic acid

C12H10O4 — CID 19868719

IUPAC4-hydroxy-6-methoxynaphthalene-2-carboxylic acid
SMILESCOc1ccc2cc(C(=O)O)cc(O)c2c1
InChIInChI=1S/C12H10O4/c1-16-9-3-2-7-4-8(12(14)15)5-11(13)10(7)6-9/h2-6,13H,1H3,(H,14,15)
InChIKeyNBVMAHBZFSNVOB-UHFFFAOYSA-N
MW218.21 g/mol
LogP2.25
Rot. Bonds2

About 4-hydroxy-6-methoxynaphthalene-2-carboxylic acid

4-hydroxy-6-methoxynaphthalene-2-carboxylic acid (PubChem CID 19868719) has the molecular formula C12H10O4 and a molecular weight of 218.21 g/mol. Its IUPAC name is 4-hydroxy-6-methoxynaphthalene-2-carboxylic acid.

Molecular Properties

Compound Name4-hydroxy-6-methoxynaphthalene-2-carboxylic acid
PubChem CID19868719
Molecular FormulaC12H10O4
Molecular Weight218.21 g/mol
Exact Mass218.06
IUPAC Name4-hydroxy-6-methoxynaphthalene-2-carboxylic acid
SMILESCOc1ccc2cc(C(=O)O)cc(O)c2c1
InChIInChI=1S/C12H10O4/c1-16-9-3-2-7-4-8(12(14)15)5-11(13)10(7)6-9/h2-6,13H,1H3,(H,14,15)
InChIKeyNBVMAHBZFSNVOB-UHFFFAOYSA-N
XLogP2.25
TPSA66.76 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.21
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-hydroxy-6-methoxynaphthalene-2-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

7-methoxy-3-methylnaphthalen-1-ol
CID 14832999
4-(6-methoxynaphthalene-2-carbonyl)benzoic acid
CID 70129561
3-hydroxy-4-(4-methoxyphenyl)benzoic acid
CID 53225437
4-methoxybenzoic acid;silver
CID 140722019
4-methoxybenzoic acid;hydrobromide
CID 172731707
(3,5-dicarboxyphenyl)-bis(4-methoxyphenyl)azanium
CID 23412525
1-(2-carboxy-4-hydroxy-6-methoxynaphthalen-1-yl)oxyphenanthrene-3-carboxylic acid
CID 130368637
4-hydroxy-5,7-dimethoxynaphthalene-2-carboxylic acid
CID 73013811
4-hydroxy-6-nitronaphthalene-2-carboxylic acid
CID 12788607
dipotassium;hydride;bis(4-methoxybenzoic acid)
CID 174966715
7-methoxy-4-(phosphanylmethoxy)naphthalene-2-carboxylic acid
CID 143812778
1-(2-hydroxy-6-methoxynaphthalen-1-yl)ethanone
CID 13085663

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-6-methoxynaphthalene-2-carboxylic acid?
The IUPAC name of 4-hydroxy-6-methoxynaphthalene-2-carboxylic acid (CID 19868719) is 4-hydroxy-6-methoxynaphthalene-2-carboxylic acid.
What is the SMILES notation for 4-hydroxy-6-methoxynaphthalene-2-carboxylic acid?
The canonical SMILES for 4-hydroxy-6-methoxynaphthalene-2-carboxylic acid is COc1ccc2cc(C(=O)O)cc(O)c2c1.
What is the InChIKey of 4-hydroxy-6-methoxynaphthalene-2-carboxylic acid?
The InChIKey is NBVMAHBZFSNVOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10O4/c1-16-9-3-2-7-4-8(12(14)15)5-11(13)10(7)6-9/h2-6,13H,1H3,(H,14,15).
What are the key properties of 4-hydroxy-6-methoxynaphthalene-2-carboxylic acid?
4-hydroxy-6-methoxynaphthalene-2-carboxylic acid has a molecular weight of 218.21 g/mol, XLogP of 2.25, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-6-methoxynaphthalene-2-carboxylic acid is sourced from PubChem (CID 19868719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).