2-(4-hydroxy-5,6-dihydro-1H-cyclopenta[d]pyrazol-4-yl)acetic acid

C8H10N2O3 — CID 83906643

IUPAC2-(4-hydroxy-5,6-dihydro-1H-cyclopenta[d]pyrazol-4-yl)acetic acid
SMILESO=C(O)CC1(O)CCc2[nH]ncc21
InChIInChI=1S/C8H10N2O3/c11-7(12)3-8(13)2-1-6-5(8)4-9-10-6/h4,13H,1-3H2,(H,9,10)(H,11,12)
InChIKeyZJPGESYMYBTPBN-UHFFFAOYSA-N
MW182.18 g/mol
LogP0.02
Rot. Bonds2

About 2-(4-hydroxy-5,6-dihydro-1H-cyclopenta[d]pyrazol-4-yl)acetic acid

2-(4-hydroxy-5,6-dihydro-1H-cyclopenta[d]pyrazol-4-yl)acetic acid (PubChem CID 83906643) has the molecular formula C8H10N2O3 and a molecular weight of 182.18 g/mol. Its IUPAC name is 2-(4-hydroxy-5,6-dihydro-1H-cyclopenta[d]pyrazol-4-yl)acetic acid.

Molecular Properties

Compound Name2-(4-hydroxy-5,6-dihydro-1H-cyclopenta[d]pyrazol-4-yl)acetic acid
PubChem CID83906643
Molecular FormulaC8H10N2O3
Molecular Weight182.18 g/mol
Exact Mass182.07
IUPAC Name2-(4-hydroxy-5,6-dihydro-1H-cyclopenta[d]pyrazol-4-yl)acetic acid
SMILESO=C(O)CC1(O)CCc2[nH]ncc21
InChIInChI=1S/C8H10N2O3/c11-7(12)3-8(13)2-1-6-5(8)4-9-10-6/h4,13H,1-3H2,(H,9,10)(H,11,12)
InChIKeyZJPGESYMYBTPBN-UHFFFAOYSA-N
XLogP0.02
TPSA86.21 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.18
LogP ≤ 50.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-hydroxy-3-(5-methyl-1H-pyrazol-4-yl)butanoic acid
CID 82406803
2-(1,4,5,6-Tetrahydrocyclopenta[d]pyrazol-4-yl)acetic acid
CID 82414343
2-(1,4,5,6-Tetrahydrocyclopenta[d]pyrazol-5-yl)acetic acid
CID 82414344
2H,4H,5H,6H-cyclopenta[c]pyrazole-4-carboxylic acid
CID 82417189
5-Methyl-1,4,5,6-tetrahydrocyclopenta[d]pyrazole-4-carboxylic acid
CID 83905522
4-(2-aminoethyl)-5,6-dihydro-1H-cyclopenta[d]pyrazol-4-ol
CID 83905570
4-hydroxy-5,6-dihydro-1H-cyclopenta[d]pyrazole-4-carboxylic acid
CID 83905660
2-(1,4,5,6-Tetrahydrocyclopenta[d]pyrazol-4-yl)propanoic acid
CID 83906434
2-[4-(aminomethyl)-5,6-dihydro-1H-cyclopenta[d]pyrazol-4-yl]acetic acid
CID 83907779
2-(4-hydroxy-3-methyl-5,6-dihydro-2H-cyclopenta[c]pyrazol-4-yl)acetic acid
CID 83907955
2-(4-Hydroxy-1,5,6,7-tetrahydroindazol-4-yl)acetic acid
CID 83907956
2-(4-Hydroxy-2-methyl-5,6-dihydrocyclopenta[c]pyrazol-4-yl)acetic acid
CID 83907957

Frequently Asked Questions

What is the IUPAC name of 2-(4-hydroxy-5,6-dihydro-1H-cyclopenta[d]pyrazol-4-yl)acetic acid?
The IUPAC name of 2-(4-hydroxy-5,6-dihydro-1H-cyclopenta[d]pyrazol-4-yl)acetic acid (CID 83906643) is 2-(4-hydroxy-5,6-dihydro-1H-cyclopenta[d]pyrazol-4-yl)acetic acid.
What is the SMILES notation for 2-(4-hydroxy-5,6-dihydro-1H-cyclopenta[d]pyrazol-4-yl)acetic acid?
The canonical SMILES for 2-(4-hydroxy-5,6-dihydro-1H-cyclopenta[d]pyrazol-4-yl)acetic acid is O=C(O)CC1(O)CCc2[nH]ncc21.
What is the InChIKey of 2-(4-hydroxy-5,6-dihydro-1H-cyclopenta[d]pyrazol-4-yl)acetic acid?
The InChIKey is ZJPGESYMYBTPBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O3/c11-7(12)3-8(13)2-1-6-5(8)4-9-10-6/h4,13H,1-3H2,(H,9,10)(H,11,12).
What are the key properties of 2-(4-hydroxy-5,6-dihydro-1H-cyclopenta[d]pyrazol-4-yl)acetic acid?
2-(4-hydroxy-5,6-dihydro-1H-cyclopenta[d]pyrazol-4-yl)acetic acid has a molecular weight of 182.18 g/mol, XLogP of 0.02, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-hydroxy-5,6-dihydro-1H-cyclopenta[d]pyrazol-4-yl)acetic acid is sourced from PubChem (CID 83906643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).