6-cyclopentylpyridine-3-carboxylic acid

C11H13NO2 — CID 82403519

IUPAC6-cyclopentylpyridine-3-carboxylic acid
SMILESO=C(O)c1ccc(C2CCCC2)nc1
InChIInChI=1S/C11H13NO2/c13-11(14)9-5-6-10(12-7-9)8-3-1-2-4-8/h5-8H,1-4H2,(H,13,14)
InChIKeyYZSICNRDDIFTGE-UHFFFAOYSA-N
MW191.23 g/mol
LogP2.44
Rot. Bonds2

About 6-cyclopentylpyridine-3-carboxylic acid

6-cyclopentylpyridine-3-carboxylic acid (PubChem CID 82403519) has the molecular formula C11H13NO2 and a molecular weight of 191.23 g/mol. Its IUPAC name is 6-cyclopentylpyridine-3-carboxylic acid.

Molecular Properties

Compound Name6-cyclopentylpyridine-3-carboxylic acid
PubChem CID82403519
Molecular FormulaC11H13NO2
Molecular Weight191.23 g/mol
Exact Mass191.09
IUPAC Name6-cyclopentylpyridine-3-carboxylic acid
SMILESO=C(O)c1ccc(C2CCCC2)nc1
InChIInChI=1S/C11H13NO2/c13-11(14)9-5-6-10(12-7-9)8-3-1-2-4-8/h5-8H,1-4H2,(H,13,14)
InChIKeyYZSICNRDDIFTGE-UHFFFAOYSA-N
XLogP2.44
TPSA50.19 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-(1,1-dioxothian-4-yl)pyridine-3-carboxylic acid
CID 115047543
6-[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-3-yl]pyridine-3-carboxylic acid
CID 115052964
6-(cyclopentylamino)pyridine-3-carboxylic acid
CID 1447952
6-cyclopropyl-N-propan-2-ylpyridine-3-carboxamide
CID 121261417
5-cyclopentylpyrazine-2-carboxylic acid
CID 135241231
4-(4-cyclopentylpyrimidin-2-yl)benzoic acid
CID 116900125
6-(cyclopentanecarbonylamino)pyridine-3-carboxylic acid
CID 22099684
1-[3-[5-(pyrrolidine-1-carbonyl)-2-pyridinyl]piperidin-1-yl]ethanone
CID 110090089
6-cyclobutylpyridazine-3-carboxylic acid
CID 171323003
6-cyclopentylpyridine-3-carbaldehyde
CID 83816590
6-(cyclopentylmethoxy)pyridine-3-carboxylic acid
CID 66324302
2-cyclohexyl-5-methylpyridine
CID 83382376

Frequently Asked Questions

What is the IUPAC name of 6-cyclopentylpyridine-3-carboxylic acid?
The IUPAC name of 6-cyclopentylpyridine-3-carboxylic acid (CID 82403519) is 6-cyclopentylpyridine-3-carboxylic acid.
What is the SMILES notation for 6-cyclopentylpyridine-3-carboxylic acid?
The canonical SMILES for 6-cyclopentylpyridine-3-carboxylic acid is O=C(O)c1ccc(C2CCCC2)nc1.
What is the InChIKey of 6-cyclopentylpyridine-3-carboxylic acid?
The InChIKey is YZSICNRDDIFTGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO2/c13-11(14)9-5-6-10(12-7-9)8-3-1-2-4-8/h5-8H,1-4H2,(H,13,14).
What are the key properties of 6-cyclopentylpyridine-3-carboxylic acid?
6-cyclopentylpyridine-3-carboxylic acid has a molecular weight of 191.23 g/mol, XLogP of 2.44, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopentylpyridine-3-carboxylic acid is sourced from PubChem (CID 82403519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).