2-[1-ethyl-5-(2-fluorophenyl)pyrazol-3-yl]ethanamine

C13H16FN3 — CID 105492850

IUPAC2-[1-ethyl-5-(2-fluorophenyl)pyrazol-3-yl]ethanamine
SMILESCCn1nc(CCN)cc1-c1ccccc1F
InChIInChI=1S/C13H16FN3/c1-2-17-13(9-10(16-17)7-8-15)11-5-3-4-6-12(11)14/h3-6,9H,2,7-8,15H2,1H3
InChIKeyNXSNRAJFQPIZRB-UHFFFAOYSA-N
MW233.29 g/mol
LogP2.21
Rot. Bonds4

About 2-[1-ethyl-5-(2-fluorophenyl)pyrazol-3-yl]ethanamine

2-[1-ethyl-5-(2-fluorophenyl)pyrazol-3-yl]ethanamine (PubChem CID 105492850) has the molecular formula C13H16FN3 and a molecular weight of 233.29 g/mol. Its IUPAC name is 2-[1-ethyl-5-(2-fluorophenyl)pyrazol-3-yl]ethanamine.

Molecular Properties

Compound Name2-[1-ethyl-5-(2-fluorophenyl)pyrazol-3-yl]ethanamine
PubChem CID105492850
Molecular FormulaC13H16FN3
Molecular Weight233.29 g/mol
Exact Mass233.13
IUPAC Name2-[1-ethyl-5-(2-fluorophenyl)pyrazol-3-yl]ethanamine
SMILESCCn1nc(CCN)cc1-c1ccccc1F
InChIInChI=1S/C13H16FN3/c1-2-17-13(9-10(16-17)7-8-15)11-5-3-4-6-12(11)14/h3-6,9H,2,7-8,15H2,1H3
InChIKeyNXSNRAJFQPIZRB-UHFFFAOYSA-N
XLogP2.21
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.29
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[1-ethyl-5-(2-fluorophenyl)pyrazol-3-yl]ethanamine 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

2-[5-(2,5-difluorophenyl)-1-methylpyrazol-3-yl]ethanamine
CID 82476618
4-(2-ethyl-5-methylpyrazol-3-yl)-3-fluoroaniline
CID 90393898
[5-(2-fluorophenyl)-1-(4-fluorophenyl)pyrazol-3-yl]methanamine
CID 82072742
2-[5-(2-chlorophenyl)-1-(4-fluorophenyl)pyrazol-3-yl]ethanamine
CID 82072636
2-[2-(3-ethylimidazol-4-yl)phenyl]ethanamine
CID 115029288
1-tert-butyl-5-(2-fluorophenyl)pyrazol-3-amine
CID 105492854
2-[5-(4-fluoro-3-methylphenyl)-1-methylpyrazol-3-yl]ethanamine
CID 82129028
3-[5-(2-fluorophenyl)triazol-1-yl]propan-1-amine
CID 115031941
1-fluoro-2-(2-propylphenyl)benzene
CID 154059621
2-[3-[1-ethyl-3-[2-(4-fluorophenyl)ethyl]pyrazol-5-yl]phenyl]propan-2-amine
CID 58757366
[1-[(2-fluorophenyl)methyl]-5-(1,2-oxazol-3-yl)pyrazol-3-yl]methanamine
CID 123260566
1-(2-chlorophenyl)-5-(2-fluorophenyl)-3-(methoxymethyl)pyrazole
CID 67848090

Frequently Asked Questions

What is the IUPAC name of 2-[1-ethyl-5-(2-fluorophenyl)pyrazol-3-yl]ethanamine?
The IUPAC name of 2-[1-ethyl-5-(2-fluorophenyl)pyrazol-3-yl]ethanamine (CID 105492850) is 2-[1-ethyl-5-(2-fluorophenyl)pyrazol-3-yl]ethanamine.
What is the SMILES notation for 2-[1-ethyl-5-(2-fluorophenyl)pyrazol-3-yl]ethanamine?
The canonical SMILES for 2-[1-ethyl-5-(2-fluorophenyl)pyrazol-3-yl]ethanamine is CCn1nc(CCN)cc1-c1ccccc1F.
What is the InChIKey of 2-[1-ethyl-5-(2-fluorophenyl)pyrazol-3-yl]ethanamine?
The InChIKey is NXSNRAJFQPIZRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16FN3/c1-2-17-13(9-10(16-17)7-8-15)11-5-3-4-6-12(11)14/h3-6,9H,2,7-8,15H2,1H3.
What are the key properties of 2-[1-ethyl-5-(2-fluorophenyl)pyrazol-3-yl]ethanamine?
2-[1-ethyl-5-(2-fluorophenyl)pyrazol-3-yl]ethanamine has a molecular weight of 233.29 g/mol, XLogP of 2.21, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-ethyl-5-(2-fluorophenyl)pyrazol-3-yl]ethanamine is sourced from PubChem (CID 105492850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).