5-chloro-6-cyclopentyloxypyridine-3-carboxylic acid

C11H12ClNO3 — CID 16796007

IUPAC5-chloro-6-cyclopentyloxypyridine-3-carboxylic acid
SMILESO=C(O)c1cnc(OC2CCCC2)c(Cl)c1
InChIInChI=1S/C11H12ClNO3/c12-9-5-7(11(14)15)6-13-10(9)16-8-3-1-2-4-8/h5-6,8H,1-4H2,(H,14,15)
InChIKeyVZPXHFACZHJVJI-UHFFFAOYSA-N
MW241.67 g/mol
LogP2.75
Rot. Bonds3

About 5-chloro-6-cyclopentyloxypyridine-3-carboxylic acid

5-chloro-6-cyclopentyloxypyridine-3-carboxylic acid (PubChem CID 16796007) has the molecular formula C11H12ClNO3 and a molecular weight of 241.67 g/mol. Its IUPAC name is 5-chloro-6-cyclopentyloxypyridine-3-carboxylic acid.

Molecular Properties

Compound Name5-chloro-6-cyclopentyloxypyridine-3-carboxylic acid
PubChem CID16796007
Molecular FormulaC11H12ClNO3
Molecular Weight241.67 g/mol
Exact Mass241.05
IUPAC Name5-chloro-6-cyclopentyloxypyridine-3-carboxylic acid
SMILESO=C(O)c1cnc(OC2CCCC2)c(Cl)c1
InChIInChI=1S/C11H12ClNO3/c12-9-5-7(11(14)15)6-13-10(9)16-8-3-1-2-4-8/h5-6,8H,1-4H2,(H,14,15)
InChIKeyVZPXHFACZHJVJI-UHFFFAOYSA-N
XLogP2.75
TPSA59.42 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.67
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-chloro-6-cyclopentyloxypyridine-3-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

Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-cyclopentyloxypyridine-3-carboxylic acid?
The IUPAC name of 5-chloro-6-cyclopentyloxypyridine-3-carboxylic acid (CID 16796007) is 5-chloro-6-cyclopentyloxypyridine-3-carboxylic acid.
What is the SMILES notation for 5-chloro-6-cyclopentyloxypyridine-3-carboxylic acid?
The canonical SMILES for 5-chloro-6-cyclopentyloxypyridine-3-carboxylic acid is O=C(O)c1cnc(OC2CCCC2)c(Cl)c1.
What is the InChIKey of 5-chloro-6-cyclopentyloxypyridine-3-carboxylic acid?
The InChIKey is VZPXHFACZHJVJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12ClNO3/c12-9-5-7(11(14)15)6-13-10(9)16-8-3-1-2-4-8/h5-6,8H,1-4H2,(H,14,15).
What are the key properties of 5-chloro-6-cyclopentyloxypyridine-3-carboxylic acid?
5-chloro-6-cyclopentyloxypyridine-3-carboxylic acid has a molecular weight of 241.67 g/mol, XLogP of 2.75, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-cyclopentyloxypyridine-3-carboxylic acid is sourced from PubChem (CID 16796007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).