4-(4-aminopyrazol-1-yl)cyclohexane-1-carboxylic acid

C10H15N3O2 — CID 84734302

IUPAC4-(4-aminopyrazol-1-yl)cyclohexane-1-carboxylic acid
SMILESNc1cnn(C2CCC(C(=O)O)CC2)c1
InChIInChI=1S/C10H15N3O2/c11-8-5-12-13(6-8)9-3-1-7(2-4-9)10(14)15/h5-7,9H,1-4,11H2,(H,14,15)
InChIKeyYLZPTPCNRDTYBV-UHFFFAOYSA-N
MW209.25 g/mol
LogP1.28
Rot. Bonds2

About 4-(4-aminopyrazol-1-yl)cyclohexane-1-carboxylic acid

4-(4-aminopyrazol-1-yl)cyclohexane-1-carboxylic acid (PubChem CID 84734302) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is 4-(4-aminopyrazol-1-yl)cyclohexane-1-carboxylic acid.

Molecular Properties

Compound Name4-(4-aminopyrazol-1-yl)cyclohexane-1-carboxylic acid
PubChem CID84734302
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Name4-(4-aminopyrazol-1-yl)cyclohexane-1-carboxylic acid
SMILESNc1cnn(C2CCC(C(=O)O)CC2)c1
InChIInChI=1S/C10H15N3O2/c11-8-5-12-13(6-8)9-3-1-7(2-4-9)10(14)15/h5-7,9H,1-4,11H2,(H,14,15)
InChIKeyYLZPTPCNRDTYBV-UHFFFAOYSA-N
XLogP1.28
TPSA81.14 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-(4-aminopyrazol-1-yl)cyclohexane-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

Frequently Asked Questions

What is the IUPAC name of 4-(4-aminopyrazol-1-yl)cyclohexane-1-carboxylic acid?
The IUPAC name of 4-(4-aminopyrazol-1-yl)cyclohexane-1-carboxylic acid (CID 84734302) is 4-(4-aminopyrazol-1-yl)cyclohexane-1-carboxylic acid.
What is the SMILES notation for 4-(4-aminopyrazol-1-yl)cyclohexane-1-carboxylic acid?
The canonical SMILES for 4-(4-aminopyrazol-1-yl)cyclohexane-1-carboxylic acid is Nc1cnn(C2CCC(C(=O)O)CC2)c1.
What is the InChIKey of 4-(4-aminopyrazol-1-yl)cyclohexane-1-carboxylic acid?
The InChIKey is YLZPTPCNRDTYBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c11-8-5-12-13(6-8)9-3-1-7(2-4-9)10(14)15/h5-7,9H,1-4,11H2,(H,14,15).
What are the key properties of 4-(4-aminopyrazol-1-yl)cyclohexane-1-carboxylic acid?
4-(4-aminopyrazol-1-yl)cyclohexane-1-carboxylic acid has a molecular weight of 209.25 g/mol, XLogP of 1.28, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-aminopyrazol-1-yl)cyclohexane-1-carboxylic acid is sourced from PubChem (CID 84734302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).