3-ethyl-1-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazole-4-carboxylic acid

C10H14N2O2 — CID 83861558

IUPAC3-ethyl-1-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazole-4-carboxylic acid
SMILESCCc1nn(C)c2c1C(C(=O)O)CC2
InChIInChI=1S/C10H14N2O2/c1-3-7-9-6(10(13)14)4-5-8(9)12(2)11-7/h6H,3-5H2,1-2H3,(H,13,14)
InChIKeyDXXVHVXJYDRIME-UHFFFAOYSA-N
MW194.23 g/mol
LogP1.10
Rot. Bonds2

About 3-ethyl-1-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazole-4-carboxylic acid

3-ethyl-1-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazole-4-carboxylic acid (PubChem CID 83861558) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is 3-ethyl-1-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazole-4-carboxylic acid.

Molecular Properties

Compound Name3-ethyl-1-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazole-4-carboxylic acid
PubChem CID83861558
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name3-ethyl-1-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazole-4-carboxylic acid
SMILESCCc1nn(C)c2c1C(C(=O)O)CC2
InChIInChI=1S/C10H14N2O2/c1-3-7-9-6(10(13)14)4-5-8(9)12(2)11-7/h6H,3-5H2,1-2H3,(H,13,14)
InChIKeyDXXVHVXJYDRIME-UHFFFAOYSA-N
XLogP1.10
TPSA55.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-ethyl-1-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazole-4-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(1,3,5-trimethyl-1H-pyrazol-4-yl)propanoic acid
CID 3157816
2-methyl-3-(trimethyl-1H-pyrazol-4-yl)propanoic acid
CID 23005992
2-(3,5-diethyl-1-methyl-1H-pyrazol-4-yl)acetic acid
CID 50987849
3-(3,5-diethyl-1-methyl-1H-pyrazol-4-yl)propanoic acid
CID 50987850
1-methyl-3-(trifluoromethyl)-5,6-dihydro-4H-cyclopenta[c]pyrazole-4-carboxylic acid
CID 83861572
2-Fluoro-3-(1,3,5-trimethylpyrazol-4-yl)butanoic acid
CID 130840915
2,2-difluoro-3-{2-methyl-2H,4H,5H,6H-cyclopenta[c]pyrazol-3-yl}propanoic acid
CID 165490617
2-fluoro-2-{2-methyl-2H,4H,5H,6H-cyclopenta[c]pyrazol-3-yl}acetic acid
CID 165493434
2,2-difluoro-2-{2-methyl-2H,4H,5H,6H-cyclopenta[c]pyrazol-3-yl}acetic acid
CID 165874559
2-[5-(Carboxymethyl)-1,3-dimethylpyrazol-4-yl]acetic acid
CID 69015971
2-(1,4,5-Trimethylpyrazol-3-yl)acetic acid
CID 82413375
2-(5-Cyclopropyl-1,3-dimethylpyrazol-4-yl)acetic acid
CID 123181406

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazole-4-carboxylic acid?
The IUPAC name of 3-ethyl-1-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazole-4-carboxylic acid (CID 83861558) is 3-ethyl-1-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazole-4-carboxylic acid.
What is the SMILES notation for 3-ethyl-1-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazole-4-carboxylic acid?
The canonical SMILES for 3-ethyl-1-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazole-4-carboxylic acid is CCc1nn(C)c2c1C(C(=O)O)CC2.
What is the InChIKey of 3-ethyl-1-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazole-4-carboxylic acid?
The InChIKey is DXXVHVXJYDRIME-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-3-7-9-6(10(13)14)4-5-8(9)12(2)11-7/h6H,3-5H2,1-2H3,(H,13,14).
What are the key properties of 3-ethyl-1-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazole-4-carboxylic acid?
3-ethyl-1-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazole-4-carboxylic acid has a molecular weight of 194.23 g/mol, XLogP of 1.10, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-methyl-5,6-dihydro-4H-cyclopenta[c]pyrazole-4-carboxylic acid is sourced from PubChem (CID 83861558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).