1-(4-ethyl-3-fluorophenyl)pyrazol-3-amine

C11H12FN3 — CID 71001979

IUPAC1-(4-ethyl-3-fluorophenyl)pyrazol-3-amine
SMILESCCc1ccc(-n2ccc(N)n2)cc1F
InChIInChI=1S/C11H12FN3/c1-2-8-3-4-9(7-10(8)12)15-6-5-11(13)14-15/h3-7H,2H2,1H3,(H2,13,14)
InChIKeyUCIPTRURTIXBDK-UHFFFAOYSA-N
MW205.24 g/mol
LogP2.16
Rot. Bonds2

About 1-(4-ethyl-3-fluorophenyl)pyrazol-3-amine

1-(4-ethyl-3-fluorophenyl)pyrazol-3-amine (PubChem CID 71001979) has the molecular formula C11H12FN3 and a molecular weight of 205.24 g/mol. Its IUPAC name is 1-(4-ethyl-3-fluorophenyl)pyrazol-3-amine.

Molecular Properties

Compound Name1-(4-ethyl-3-fluorophenyl)pyrazol-3-amine
PubChem CID71001979
Molecular FormulaC11H12FN3
Molecular Weight205.24 g/mol
Exact Mass205.10
IUPAC Name1-(4-ethyl-3-fluorophenyl)pyrazol-3-amine
SMILESCCc1ccc(-n2ccc(N)n2)cc1F
InChIInChI=1S/C11H12FN3/c1-2-8-3-4-9(7-10(8)12)15-6-5-11(13)14-15/h3-7H,2H2,1H3,(H2,13,14)
InChIKeyUCIPTRURTIXBDK-UHFFFAOYSA-N
XLogP2.16
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.24
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(4-ethyl-3-fluorophenyl)pyrazol-3-amine?
The IUPAC name of 1-(4-ethyl-3-fluorophenyl)pyrazol-3-amine (CID 71001979) is 1-(4-ethyl-3-fluorophenyl)pyrazol-3-amine.
What is the SMILES notation for 1-(4-ethyl-3-fluorophenyl)pyrazol-3-amine?
The canonical SMILES for 1-(4-ethyl-3-fluorophenyl)pyrazol-3-amine is CCc1ccc(-n2ccc(N)n2)cc1F.
What is the InChIKey of 1-(4-ethyl-3-fluorophenyl)pyrazol-3-amine?
The InChIKey is UCIPTRURTIXBDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12FN3/c1-2-8-3-4-9(7-10(8)12)15-6-5-11(13)14-15/h3-7H,2H2,1H3,(H2,13,14).
What are the key properties of 1-(4-ethyl-3-fluorophenyl)pyrazol-3-amine?
1-(4-ethyl-3-fluorophenyl)pyrazol-3-amine has a molecular weight of 205.24 g/mol, XLogP of 2.16, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethyl-3-fluorophenyl)pyrazol-3-amine is sourced from PubChem (CID 71001979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).