2-ethyl-4,6-dihydrofuro[3,4-c]pyrazole-3-carboxylic acid

C8H10N2O3 — CID 105439884

IUPAC2-ethyl-4,6-dihydrofuro[3,4-c]pyrazole-3-carboxylic acid
SMILESCCn1nc2c(c1C(=O)O)COC2
InChIInChI=1S/C8H10N2O3/c1-2-10-7(8(11)12)5-3-13-4-6(5)9-10/h2-4H2,1H3,(H,11,12)
InChIKeyOSGOFTJIMHWPQG-UHFFFAOYSA-N
MW182.18 g/mol
LogP0.63
Rot. Bonds2

About 2-ethyl-4,6-dihydrofuro[3,4-c]pyrazole-3-carboxylic acid

2-ethyl-4,6-dihydrofuro[3,4-c]pyrazole-3-carboxylic acid (PubChem CID 105439884) has the molecular formula C8H10N2O3 and a molecular weight of 182.18 g/mol. Its IUPAC name is 2-ethyl-4,6-dihydrofuro[3,4-c]pyrazole-3-carboxylic acid.

Molecular Properties

Compound Name2-ethyl-4,6-dihydrofuro[3,4-c]pyrazole-3-carboxylic acid
PubChem CID105439884
Molecular FormulaC8H10N2O3
Molecular Weight182.18 g/mol
Exact Mass182.07
IUPAC Name2-ethyl-4,6-dihydrofuro[3,4-c]pyrazole-3-carboxylic acid
SMILESCCn1nc2c(c1C(=O)O)COC2
InChIInChI=1S/C8H10N2O3/c1-2-10-7(8(11)12)5-3-13-4-6(5)9-10/h2-4H2,1H3,(H,11,12)
InChIKeyOSGOFTJIMHWPQG-UHFFFAOYSA-N
XLogP0.63
TPSA64.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.18
LogP ≤ 50.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-ethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxylic acid
CID 105448944
2-(2-methyl-4,6-dihydrofuro[3,4-c]pyrazol-3-yl)acetic acid
CID 112711092
2-tert-butyl-6,7-dihydro-4H-pyrano[4,3-c]pyrazole-3-carboxylic acid
CID 105481851
2-ethyl-5,6-dihydro-4H-cyclopenta[c]pyrazole-3-carbohydrazide
CID 170590420
2-(2-hydroxyethyl)-5-methyl-4,6-dihydropyrrolo[3,4-c]pyrazole-3-carboxylic acid
CID 105464804
1-ethyl-3-(oxolan-3-yl)pyrazole-5-carboxylic acid
CID 131606295
1-ethyl-3-methyl-4-sulfamoylpyrazole-5-carboxylic acid
CID 66125014
1-ethyl-4,5-dimethylpyrazole-3-carboxylic acid
CID 89432142
4-(ethoxymethyl)-1-ethylpyrazole-5-carboxylic acid
CID 117216852
oxan-4-ylmethyl 4-amino-1-ethyl-3-methylpyrazole-5-carboxylate
CID 66124690
5-bromo-2-ethylindazole-3-carboxylic acid
CID 84729960
4-(4-amino-1-ethyl-3-methylpyrazol-5-yl)morpholine-3-carboxamide
CID 83101182

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-4,6-dihydrofuro[3,4-c]pyrazole-3-carboxylic acid?
The IUPAC name of 2-ethyl-4,6-dihydrofuro[3,4-c]pyrazole-3-carboxylic acid (CID 105439884) is 2-ethyl-4,6-dihydrofuro[3,4-c]pyrazole-3-carboxylic acid.
What is the SMILES notation for 2-ethyl-4,6-dihydrofuro[3,4-c]pyrazole-3-carboxylic acid?
The canonical SMILES for 2-ethyl-4,6-dihydrofuro[3,4-c]pyrazole-3-carboxylic acid is CCn1nc2c(c1C(=O)O)COC2.
What is the InChIKey of 2-ethyl-4,6-dihydrofuro[3,4-c]pyrazole-3-carboxylic acid?
The InChIKey is OSGOFTJIMHWPQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O3/c1-2-10-7(8(11)12)5-3-13-4-6(5)9-10/h2-4H2,1H3,(H,11,12).
What are the key properties of 2-ethyl-4,6-dihydrofuro[3,4-c]pyrazole-3-carboxylic acid?
2-ethyl-4,6-dihydrofuro[3,4-c]pyrazole-3-carboxylic acid has a molecular weight of 182.18 g/mol, XLogP of 0.63, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4,6-dihydrofuro[3,4-c]pyrazole-3-carboxylic acid is sourced from PubChem (CID 105439884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).