4-(3-chloro-5-ethyl-4-fluorophenyl)-1H-pyrazol-5-amine

C11H11ClFN3 — CID 117351847

IUPAC4-(3-chloro-5-ethyl-4-fluorophenyl)-1H-pyrazol-5-amine
SMILESCCc1cc(-c2cn[nH]c2N)cc(Cl)c1F
InChIInChI=1S/C11H11ClFN3/c1-2-6-3-7(4-9(12)10(6)13)8-5-15-16-11(8)14/h3-5H,2H2,1H3,(H3,14,15,16)
InChIKeyWXUDIJNNNLUNSS-UHFFFAOYSA-N
MW239.68 g/mol
LogP3.01
Rot. Bonds2

About 4-(3-chloro-5-ethyl-4-fluorophenyl)-1H-pyrazol-5-amine

4-(3-chloro-5-ethyl-4-fluorophenyl)-1H-pyrazol-5-amine (PubChem CID 117351847) has the molecular formula C11H11ClFN3 and a molecular weight of 239.68 g/mol. Its IUPAC name is 4-(3-chloro-5-ethyl-4-fluorophenyl)-1H-pyrazol-5-amine.

Molecular Properties

Compound Name4-(3-chloro-5-ethyl-4-fluorophenyl)-1H-pyrazol-5-amine
PubChem CID117351847
Molecular FormulaC11H11ClFN3
Molecular Weight239.68 g/mol
Exact Mass239.06
IUPAC Name4-(3-chloro-5-ethyl-4-fluorophenyl)-1H-pyrazol-5-amine
SMILESCCc1cc(-c2cn[nH]c2N)cc(Cl)c1F
InChIInChI=1S/C11H11ClFN3/c1-2-6-3-7(4-9(12)10(6)13)8-5-15-16-11(8)14/h3-5H,2H2,1H3,(H3,14,15,16)
InChIKeyWXUDIJNNNLUNSS-UHFFFAOYSA-N
XLogP3.01
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.68
LogP ≤ 53.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-(3-chloro-5-ethyl-4-fluorophenyl)-1H-pyrazol-5-amine 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

4-(3-bromo-5-chloro-4-fluorophenyl)-1H-pyrazol-5-amine
CID 117469643
4-(3,5-difluoro-4-methylphenyl)-1H-pyrazol-5-amine
CID 117298238
3-(3-chloro-5-ethyl-4-fluorophenyl)-1H-pyrazole-5-carboxylic acid
CID 117425059
4-(3-chloro-4-methylsulfonylphenyl)-1H-pyrazol-5-amine
CID 117432033
4-(3-chloro-5-ethyl-2,4-dimethoxyphenyl)-1H-pyrazol-5-amine
CID 117452228
4-(7-chloro-2,2-dimethyl-1,3-benzodioxol-5-yl)-1H-pyrazol-5-amine
CID 117418419
4-(4-chloro-1-methylindol-6-yl)-1H-pyrazol-5-amine
CID 117369267
4-(7-chloro-4-ethyl-1,3-benzodioxol-5-yl)-1H-pyrazol-5-amine
CID 117418417
3-(5-amino-1H-pyrazol-4-yl)-5-chloro-4-fluoro-2-methoxyphenol
CID 117397370
4-(3-chloro-2-fluorophenyl)-1H-pyrazol-5-amine
CID 82803223
4-(2-chloro-3-ethyl-5,6-dimethoxyphenyl)-1H-pyrazol-5-amine
CID 117452223
4-(3,5-dimethoxyphenyl)-1H-pyrazol-5-amine
CID 978094

Frequently Asked Questions

What is the IUPAC name of 4-(3-chloro-5-ethyl-4-fluorophenyl)-1H-pyrazol-5-amine?
The IUPAC name of 4-(3-chloro-5-ethyl-4-fluorophenyl)-1H-pyrazol-5-amine (CID 117351847) is 4-(3-chloro-5-ethyl-4-fluorophenyl)-1H-pyrazol-5-amine.
What is the SMILES notation for 4-(3-chloro-5-ethyl-4-fluorophenyl)-1H-pyrazol-5-amine?
The canonical SMILES for 4-(3-chloro-5-ethyl-4-fluorophenyl)-1H-pyrazol-5-amine is CCc1cc(-c2cn[nH]c2N)cc(Cl)c1F.
What is the InChIKey of 4-(3-chloro-5-ethyl-4-fluorophenyl)-1H-pyrazol-5-amine?
The InChIKey is WXUDIJNNNLUNSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11ClFN3/c1-2-6-3-7(4-9(12)10(6)13)8-5-15-16-11(8)14/h3-5H,2H2,1H3,(H3,14,15,16).
What are the key properties of 4-(3-chloro-5-ethyl-4-fluorophenyl)-1H-pyrazol-5-amine?
4-(3-chloro-5-ethyl-4-fluorophenyl)-1H-pyrazol-5-amine has a molecular weight of 239.68 g/mol, XLogP of 3.01, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-chloro-5-ethyl-4-fluorophenyl)-1H-pyrazol-5-amine is sourced from PubChem (CID 117351847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).