2-(3-cyclopentyl-5-methoxypyrazol-1-yl)acetic acid

C11H16N2O3 — CID 84725509

IUPAC2-(3-cyclopentyl-5-methoxypyrazol-1-yl)acetic acid
SMILESCOc1cc(C2CCCC2)nn1CC(=O)O
InChIInChI=1S/C11H16N2O3/c1-16-10-6-9(8-4-2-3-5-8)12-13(10)7-11(14)15/h6,8H,2-5,7H2,1H3,(H,14,15)
InChIKeyXPPUFMKFVWWNSX-UHFFFAOYSA-N
MW224.26 g/mol
LogP1.63
Rot. Bonds4

About 2-(3-cyclopentyl-5-methoxypyrazol-1-yl)acetic acid

2-(3-cyclopentyl-5-methoxypyrazol-1-yl)acetic acid (PubChem CID 84725509) has the molecular formula C11H16N2O3 and a molecular weight of 224.26 g/mol. Its IUPAC name is 2-(3-cyclopentyl-5-methoxypyrazol-1-yl)acetic acid.

Molecular Properties

Compound Name2-(3-cyclopentyl-5-methoxypyrazol-1-yl)acetic acid
PubChem CID84725509
Molecular FormulaC11H16N2O3
Molecular Weight224.26 g/mol
Exact Mass224.12
IUPAC Name2-(3-cyclopentyl-5-methoxypyrazol-1-yl)acetic acid
SMILESCOc1cc(C2CCCC2)nn1CC(=O)O
InChIInChI=1S/C11H16N2O3/c1-16-10-6-9(8-4-2-3-5-8)12-13(10)7-11(14)15/h6,8H,2-5,7H2,1H3,(H,14,15)
InChIKeyXPPUFMKFVWWNSX-UHFFFAOYSA-N
XLogP1.63
TPSA64.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(6-cyclopentylimidazo[2,1-e]pyrazol-1-yl)acetic acid
CID 121214868
2-(6-cyclobutylimidazo[2,1-e]pyrazol-1-yl)acetic acid
CID 121214849
3-cyclobutyl-5-methoxy-1-pyrrolidin-3-ylpyrazole
CID 84724817
2-[4-[[(3-cyclopentyl-1-methylpyrazole-5-carbonyl)amino]methyl]cyclohexyl]acetic acid
CID 154848159
2-(6-cyclobutyl-1-oxo-4-propan-2-ylphthalazin-2-yl)acetic acid
CID 162363887
methyl 3-cyclopropyl-1-ethylpyrazole-5-carboxylate
CID 25247505
2-cyclopentyl-4-(2-methylpropyl)-7-oxopyrazolo[1,5-a]pyrimidine-5-carboxylic acid
CID 82271519
N-(3-cyclopentyl-1-methylpyrazol-5-yl)-2-methylpropanamide
CID 91529109
2-[3-[1-[(2-fluoro-5-methoxyphenyl)methyl]piperidin-3-yl]pyrazol-1-yl]acetic acid
CID 119069299
ethyl 2-[3-cyclopropyl-5-(difluoromethyl)pyrazol-1-yl]acetate
CID 7017150
N-[2-(3,5-dicyclopropylpyrazol-1-yl)ethyl]-2,2-diphenylacetamide
CID 121139309
3-(5-cyclobutyl-1-ethylpyrazol-3-yl)propanoic acid
CID 105479284

Frequently Asked Questions

What is the IUPAC name of 2-(3-cyclopentyl-5-methoxypyrazol-1-yl)acetic acid?
The IUPAC name of 2-(3-cyclopentyl-5-methoxypyrazol-1-yl)acetic acid (CID 84725509) is 2-(3-cyclopentyl-5-methoxypyrazol-1-yl)acetic acid.
What is the SMILES notation for 2-(3-cyclopentyl-5-methoxypyrazol-1-yl)acetic acid?
The canonical SMILES for 2-(3-cyclopentyl-5-methoxypyrazol-1-yl)acetic acid is COc1cc(C2CCCC2)nn1CC(=O)O.
What is the InChIKey of 2-(3-cyclopentyl-5-methoxypyrazol-1-yl)acetic acid?
The InChIKey is XPPUFMKFVWWNSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O3/c1-16-10-6-9(8-4-2-3-5-8)12-13(10)7-11(14)15/h6,8H,2-5,7H2,1H3,(H,14,15).
What are the key properties of 2-(3-cyclopentyl-5-methoxypyrazol-1-yl)acetic acid?
2-(3-cyclopentyl-5-methoxypyrazol-1-yl)acetic acid has a molecular weight of 224.26 g/mol, XLogP of 1.63, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-cyclopentyl-5-methoxypyrazol-1-yl)acetic acid is sourced from PubChem (CID 84725509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).