trans-(1R,2R)-2-(2-propan-2-ylpyrazol-3-yl)cyclopropane-1-carboxylic acid

C10H14N2O2 — CID 124745805

IUPACtrans-(1R,2R)-2-(2-propan-2-ylpyrazol-3-yl)cyclopropane-1-carboxylic acid
SMILESCC(C)n1nccc1[C@@H]1C[C@H]1C(=O)O
InChIInChI=1S/C10H14N2O2/c1-6(2)12-9(3-4-11-12)7-5-8(7)10(13)14/h3-4,6-8H,5H2,1-2H3,(H,13,14)/t7-,8-/m1/s1
InChIKeyIMNOPXLYIQUOMX-HTQZYQBOSA-N
MW194.23 g/mol
LogP1.65
Rot. Bonds3

About trans-(1R,2R)-2-(2-propan-2-ylpyrazol-3-yl)cyclopropane-1-carboxylic acid

trans-(1R,2R)-2-(2-propan-2-ylpyrazol-3-yl)cyclopropane-1-carboxylic acid (PubChem CID 124745805) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is trans-(1R,2R)-2-(2-propan-2-ylpyrazol-3-yl)cyclopropane-1-carboxylic acid.

Molecular Properties

Compound Nametrans-(1R,2R)-2-(2-propan-2-ylpyrazol-3-yl)cyclopropane-1-carboxylic acid
PubChem CID124745805
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Nametrans-(1R,2R)-2-(2-propan-2-ylpyrazol-3-yl)cyclopropane-1-carboxylic acid
SMILESCC(C)n1nccc1[C@@H]1C[C@H]1C(=O)O
InChIInChI=1S/C10H14N2O2/c1-6(2)12-9(3-4-11-12)7-5-8(7)10(13)14/h3-4,6-8H,5H2,1-2H3,(H,13,14)/t7-,8-/m1/s1
InChIKeyIMNOPXLYIQUOMX-HTQZYQBOSA-N
XLogP1.65
TPSA55.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze trans-(1R,2R)-2-(2-propan-2-ylpyrazol-3-yl)cyclopropane-1-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-ethyl-3-methyl-1H-pyrazol-4-yl)propanoic acid
CID 6485397
rac-(1R,2R)-2-(1-methyl-1H-pyrazol-5-yl)cyclopropane-1-carboxylic acid
CID 124602659
2-(1-methyl-1H-pyrazol-3-yl)cyclopropane-1-carboxylic acid
CID 129321797
3-(1-methyl-1H-pyrazol-3-yl)propanoic acid
CID 19622629
3-(1-methyl-1H-pyrazol-5-yl)propanoic acid
CID 19622632
4H,5H,6H,7H-pyrazolo[1,5-a]pyridine-5-carboxylic acid
CID 83680740
4H,5H,6H,7H-pyrazolo[1,5-a]pyridine-6-carboxylic acid
CID 83815902
3-(1,5-dimethyl-1H-pyrazol-4-yl)propanoic acid
CID 19616562
3-(1,3-dimethyl-1H-pyrazol-4-yl)propanoic acid
CID 19621371
1-(1-methyl-1H-pyrazol-3-yl)cyclopropane-1-carboxylic acid
CID 82597064
rac-(2R,3R)-1-methyl-2-(1-methyl-1H-pyrazol-5-yl)-6-oxopiperidine-3-carboxylic acid
CID 99713738
rac-(2R,3R)-1-ethyl-2-(1-methyl-1H-pyrazol-5-yl)-6-oxopiperidine-3-carboxylic acid
CID 122155896

Frequently Asked Questions

What is the IUPAC name of trans-(1R,2R)-2-(2-propan-2-ylpyrazol-3-yl)cyclopropane-1-carboxylic acid?
The IUPAC name of trans-(1R,2R)-2-(2-propan-2-ylpyrazol-3-yl)cyclopropane-1-carboxylic acid (CID 124745805) is trans-(1R,2R)-2-(2-propan-2-ylpyrazol-3-yl)cyclopropane-1-carboxylic acid.
What is the SMILES notation for trans-(1R,2R)-2-(2-propan-2-ylpyrazol-3-yl)cyclopropane-1-carboxylic acid?
The canonical SMILES for trans-(1R,2R)-2-(2-propan-2-ylpyrazol-3-yl)cyclopropane-1-carboxylic acid is CC(C)n1nccc1[C@@H]1C[C@H]1C(=O)O.
What is the InChIKey of trans-(1R,2R)-2-(2-propan-2-ylpyrazol-3-yl)cyclopropane-1-carboxylic acid?
The InChIKey is IMNOPXLYIQUOMX-HTQZYQBOSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-6(2)12-9(3-4-11-12)7-5-8(7)10(13)14/h3-4,6-8H,5H2,1-2H3,(H,13,14)/t7-,8-/m1/s1.
What are the key properties of trans-(1R,2R)-2-(2-propan-2-ylpyrazol-3-yl)cyclopropane-1-carboxylic acid?
trans-(1R,2R)-2-(2-propan-2-ylpyrazol-3-yl)cyclopropane-1-carboxylic acid has a molecular weight of 194.23 g/mol, XLogP of 1.65, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1R,2R)-2-(2-propan-2-ylpyrazol-3-yl)cyclopropane-1-carboxylic acid is sourced from PubChem (CID 124745805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).