4-(6-methoxynaphthalen-2-yl)pyridine-2-carboxylic acid

C17H13NO3 — CID 58138528

IUPAC4-(6-methoxynaphthalen-2-yl)pyridine-2-carboxylic acid
SMILESCOc1ccc2cc(-c3ccnc(C(=O)O)c3)ccc2c1
InChIInChI=1S/C17H13NO3/c1-21-15-5-4-12-8-11(2-3-13(12)9-15)14-6-7-18-16(10-14)17(19)20/h2-10H,1H3,(H,19,20)
InChIKeyLSSHFCRKNYBNCT-UHFFFAOYSA-N
MW279.30 g/mol
LogP3.61
Rot. Bonds3

About 4-(6-methoxynaphthalen-2-yl)pyridine-2-carboxylic acid

4-(6-methoxynaphthalen-2-yl)pyridine-2-carboxylic acid (PubChem CID 58138528) has the molecular formula C17H13NO3 and a molecular weight of 279.30 g/mol. Its IUPAC name is 4-(6-methoxynaphthalen-2-yl)pyridine-2-carboxylic acid.

Molecular Properties

Compound Name4-(6-methoxynaphthalen-2-yl)pyridine-2-carboxylic acid
PubChem CID58138528
Molecular FormulaC17H13NO3
Molecular Weight279.30 g/mol
Exact Mass279.09
IUPAC Name4-(6-methoxynaphthalen-2-yl)pyridine-2-carboxylic acid
SMILESCOc1ccc2cc(-c3ccnc(C(=O)O)c3)ccc2c1
InChIInChI=1S/C17H13NO3/c1-21-15-5-4-12-8-11(2-3-13(12)9-15)14-6-7-18-16(10-14)17(19)20/h2-10H,1H3,(H,19,20)
InChIKeyLSSHFCRKNYBNCT-UHFFFAOYSA-N
XLogP3.61
TPSA59.42 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.30
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(3,5-dimethoxyphenyl)pyridine-2-carboxylic acid
CID 53223777
4-(3,4-dimethoxyphenyl)pyridine-2-carboxylic acid
CID 53223762
2-methoxy-6-(4-methoxyphenyl)naphthalene
CID 11149734
4-[(7-methoxyisoquinolin-1-yl)amino]pyridine-2-carboxylic acid
CID 135186665
1-[4-(6-methoxynaphthalen-2-yl)phenyl]ethanone;1-(4-methoxyphenyl)ethanone
CID 91415101
5-(4-methoxyphenyl)pyridine-2-carboxylic acid
CID 52983912
2-methoxy-6-phenylnaphthalene
CID 11253308
2-(3,5-dimethoxyphenoxy)pyrimidine-4-carboxylic acid
CID 107554624
2-(4-methoxyphenyl)sulfanylpyrimidine-4-carboxylic acid
CID 107555127
2-methoxynaphthalene;2-phenylnaphthalene
CID 173269029
4-[(2-hydroxy-5-methoxybenzoyl)amino]pyridine-2-carboxylic acid
CID 63650620
4-(1H-pyrazol-4-yl)pyridine-2-carboxylic acid
CID 82404796

Frequently Asked Questions

What is the IUPAC name of 4-(6-methoxynaphthalen-2-yl)pyridine-2-carboxylic acid?
The IUPAC name of 4-(6-methoxynaphthalen-2-yl)pyridine-2-carboxylic acid (CID 58138528) is 4-(6-methoxynaphthalen-2-yl)pyridine-2-carboxylic acid.
What is the SMILES notation for 4-(6-methoxynaphthalen-2-yl)pyridine-2-carboxylic acid?
The canonical SMILES for 4-(6-methoxynaphthalen-2-yl)pyridine-2-carboxylic acid is COc1ccc2cc(-c3ccnc(C(=O)O)c3)ccc2c1.
What is the InChIKey of 4-(6-methoxynaphthalen-2-yl)pyridine-2-carboxylic acid?
The InChIKey is LSSHFCRKNYBNCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13NO3/c1-21-15-5-4-12-8-11(2-3-13(12)9-15)14-6-7-18-16(10-14)17(19)20/h2-10H,1H3,(H,19,20).
What are the key properties of 4-(6-methoxynaphthalen-2-yl)pyridine-2-carboxylic acid?
4-(6-methoxynaphthalen-2-yl)pyridine-2-carboxylic acid has a molecular weight of 279.30 g/mol, XLogP of 3.61, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-methoxynaphthalen-2-yl)pyridine-2-carboxylic acid is sourced from PubChem (CID 58138528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).