3-cyclopropyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-4-carboxylic acid

C10H12N2O2 — CID 83861641

IUPAC3-cyclopropyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-4-carboxylic acid
SMILESO=C(O)C1CCc2[nH]nc(C3CC3)c21
InChIInChI=1S/C10H12N2O2/c13-10(14)6-3-4-7-8(6)9(12-11-7)5-1-2-5/h5-6H,1-4H2,(H,11,12)(H,13,14)
InChIKeyPACJSCWKAZWTMM-UHFFFAOYSA-N
MW192.22 g/mol
LogP1.40
Rot. Bonds2

About 3-cyclopropyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-4-carboxylic acid

3-cyclopropyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-4-carboxylic acid (PubChem CID 83861641) has the molecular formula C10H12N2O2 and a molecular weight of 192.22 g/mol. Its IUPAC name is 3-cyclopropyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-4-carboxylic acid.

Molecular Properties

Compound Name3-cyclopropyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-4-carboxylic acid
PubChem CID83861641
Molecular FormulaC10H12N2O2
Molecular Weight192.22 g/mol
Exact Mass192.09
IUPAC Name3-cyclopropyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-4-carboxylic acid
SMILESO=C(O)C1CCc2[nH]nc(C3CC3)c21
InChIInChI=1S/C10H12N2O2/c13-10(14)6-3-4-7-8(6)9(12-11-7)5-1-2-5/h5-6H,1-4H2,(H,11,12)(H,13,14)
InChIKeyPACJSCWKAZWTMM-UHFFFAOYSA-N
XLogP1.40
TPSA65.98 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.22
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-{1H,4H,5H,6H-cyclopenta[c]pyrazol-3-yl}acetic acid
CID 83858867
2-[5,5-difluoro-3-(trifluoromethyl)-4,6-dihydro-1H-cyclopenta[c]pyrazol-4-yl]acetic acid
CID 71185034
2-[4,4-difluoro-3-(trifluoromethyl)-5,6-dihydro-1H-cyclopenta[c]pyrazol-5-yl]acetic acid
CID 71185055
3-(Trifluoromethyl)-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-4-carboxylic acid
CID 83861625
2-[3-(Trifluoromethyl)-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-4-yl]acetic acid
CID 83861629
5-amino-3-(trifluoromethyl)-4,6-dihydro-1H-cyclopenta[d]pyrazole-5-carboxylic acid
CID 112483025
3-(Trifluoromethyl)-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-5-carboxylic acid
CID 112485977
3-(5-cyclopropyl-3-(trifluoromethyl)-1H-pyrazol-4-yl)propanoic acid
CID 121213214
3-{1H,4H,5H,6H-cyclopenta[c]pyrazol-3-yl}-2,2-difluoropropanoic acid
CID 165629901
3-{1H,4H,5H,6H-cyclopenta[c]pyrazol-3-yl}-4,4,4-trifluorobutanoic acid
CID 165629906
3-{1H,4H,5H,6H-cyclopenta[c]pyrazol-3-yl}-3,3-difluoropropanoic acid
CID 165633925
1-{1H,4H,5H,6H-cyclopenta[c]pyrazol-3-yl}-4,4-difluorocyclohexane-1-carboxylic acid
CID 165652701

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-4-carboxylic acid?
The IUPAC name of 3-cyclopropyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-4-carboxylic acid (CID 83861641) is 3-cyclopropyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-4-carboxylic acid.
What is the SMILES notation for 3-cyclopropyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-4-carboxylic acid?
The canonical SMILES for 3-cyclopropyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-4-carboxylic acid is O=C(O)C1CCc2[nH]nc(C3CC3)c21.
What is the InChIKey of 3-cyclopropyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-4-carboxylic acid?
The InChIKey is PACJSCWKAZWTMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O2/c13-10(14)6-3-4-7-8(6)9(12-11-7)5-1-2-5/h5-6H,1-4H2,(H,11,12)(H,13,14).
What are the key properties of 3-cyclopropyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-4-carboxylic acid?
3-cyclopropyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-4-carboxylic acid has a molecular weight of 192.22 g/mol, XLogP of 1.40, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-4-carboxylic acid is sourced from PubChem (CID 83861641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).