6-(cyclopentylmethoxy)pyridine-3-carboxylic acid

C12H15NO3 — CID 66324302

IUPAC6-(cyclopentylmethoxy)pyridine-3-carboxylic acid
SMILESO=C(O)c1ccc(OCC2CCCC2)nc1
InChIInChI=1S/C12H15NO3/c14-12(15)10-5-6-11(13-7-10)16-8-9-3-1-2-4-9/h5-7,9H,1-4,8H2,(H,14,15)
InChIKeyULGCKCIRPQWRRF-UHFFFAOYSA-N
MW221.26 g/mol
LogP2.35
Rot. Bonds4

About 6-(cyclopentylmethoxy)pyridine-3-carboxylic acid

6-(cyclopentylmethoxy)pyridine-3-carboxylic acid (PubChem CID 66324302) has the molecular formula C12H15NO3 and a molecular weight of 221.26 g/mol. Its IUPAC name is 6-(cyclopentylmethoxy)pyridine-3-carboxylic acid.

Molecular Properties

Compound Name6-(cyclopentylmethoxy)pyridine-3-carboxylic acid
PubChem CID66324302
Molecular FormulaC12H15NO3
Molecular Weight221.26 g/mol
Exact Mass221.11
IUPAC Name6-(cyclopentylmethoxy)pyridine-3-carboxylic acid
SMILESO=C(O)c1ccc(OCC2CCCC2)nc1
InChIInChI=1S/C12H15NO3/c14-12(15)10-5-6-11(13-7-10)16-8-9-3-1-2-4-9/h5-7,9H,1-4,8H2,(H,14,15)
InChIKeyULGCKCIRPQWRRF-UHFFFAOYSA-N
XLogP2.35
TPSA59.42 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(cyclopropylmethoxy)pyridine-3-carbonyl chloride
CID 118481303
6-[(1-methylpiperidin-2-yl)methoxy]pyridine-3-carboxylic acid
CID 65471120
5-[6-(cyclopentylmethoxy)-3-pyridinyl]pentanoic acid
CID 174523049
4-amino-3-(cyclopentylmethoxy)benzoic acid
CID 61344123
N,N-dimethyl-6-(oxan-4-ylmethoxy)pyridine-3-carboxamide
CID 91815390
6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyridine-3-carboxylic acid
CID 61101138
2-[[6-(cyclopropylmethoxy)pyridine-3-carbonyl]amino]-1,3-benzothiazole-6-carboxylic acid
CID 166127480
ethyl 6-(piperidin-4-ylmethoxy)pyridine-3-carboxylate
CID 62348809
6-(cyclopropylmethoxy)-N-[(2-hydroxycyclopentyl)methyl]-N-methylpyridine-3-carboxamide
CID 109400138
6-[[4-[3-(cyclopropylmethoxy)phenoxy]-2,6-difluorophenyl]methoxy]pyridine-3-carboxylic acid
CID 134226939
5-(cyclopentylmethoxy)pyridine-2-carboxylic acid
CID 79794070
6-cyclopentylpyridine-3-carboxylic acid
CID 82403519

Frequently Asked Questions

What is the IUPAC name of 6-(cyclopentylmethoxy)pyridine-3-carboxylic acid?
The IUPAC name of 6-(cyclopentylmethoxy)pyridine-3-carboxylic acid (CID 66324302) is 6-(cyclopentylmethoxy)pyridine-3-carboxylic acid.
What is the SMILES notation for 6-(cyclopentylmethoxy)pyridine-3-carboxylic acid?
The canonical SMILES for 6-(cyclopentylmethoxy)pyridine-3-carboxylic acid is O=C(O)c1ccc(OCC2CCCC2)nc1.
What is the InChIKey of 6-(cyclopentylmethoxy)pyridine-3-carboxylic acid?
The InChIKey is ULGCKCIRPQWRRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO3/c14-12(15)10-5-6-11(13-7-10)16-8-9-3-1-2-4-9/h5-7,9H,1-4,8H2,(H,14,15).
What are the key properties of 6-(cyclopentylmethoxy)pyridine-3-carboxylic acid?
6-(cyclopentylmethoxy)pyridine-3-carboxylic acid has a molecular weight of 221.26 g/mol, XLogP of 2.35, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(cyclopentylmethoxy)pyridine-3-carboxylic acid is sourced from PubChem (CID 66324302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).