1-ethyl-3-(3-fluorophenyl)pyrazol-5-amine

C11H12FN3 — CID 61265903

IUPAC1-ethyl-3-(3-fluorophenyl)pyrazol-5-amine
SMILESCCn1nc(-c2cccc(F)c2)cc1N
InChIInChI=1S/C11H12FN3/c1-2-15-11(13)7-10(14-15)8-4-3-5-9(12)6-8/h3-7H,2,13H2,1H3
InChIKeyOBCMVQSZXWNVLF-UHFFFAOYSA-N
MW205.24 g/mol
LogP2.29
Rot. Bonds2

About 1-ethyl-3-(3-fluorophenyl)pyrazol-5-amine

1-ethyl-3-(3-fluorophenyl)pyrazol-5-amine (PubChem CID 61265903) has the molecular formula C11H12FN3 and a molecular weight of 205.24 g/mol. Its IUPAC name is 1-ethyl-3-(3-fluorophenyl)pyrazol-5-amine.

Molecular Properties

Compound Name1-ethyl-3-(3-fluorophenyl)pyrazol-5-amine
PubChem CID61265903
Molecular FormulaC11H12FN3
Molecular Weight205.24 g/mol
Exact Mass205.10
IUPAC Name1-ethyl-3-(3-fluorophenyl)pyrazol-5-amine
SMILESCCn1nc(-c2cccc(F)c2)cc1N
InChIInChI=1S/C11H12FN3/c1-2-15-11(13)7-10(14-15)8-4-3-5-9(12)6-8/h3-7H,2,13H2,1H3
InChIKeyOBCMVQSZXWNVLF-UHFFFAOYSA-N
XLogP2.29
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 ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-(3-fluorophenyl)pyrazol-5-amine?
The IUPAC name of 1-ethyl-3-(3-fluorophenyl)pyrazol-5-amine (CID 61265903) is 1-ethyl-3-(3-fluorophenyl)pyrazol-5-amine.
What is the SMILES notation for 1-ethyl-3-(3-fluorophenyl)pyrazol-5-amine?
The canonical SMILES for 1-ethyl-3-(3-fluorophenyl)pyrazol-5-amine is CCn1nc(-c2cccc(F)c2)cc1N.
What is the InChIKey of 1-ethyl-3-(3-fluorophenyl)pyrazol-5-amine?
The InChIKey is OBCMVQSZXWNVLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12FN3/c1-2-15-11(13)7-10(14-15)8-4-3-5-9(12)6-8/h3-7H,2,13H2,1H3.
What are the key properties of 1-ethyl-3-(3-fluorophenyl)pyrazol-5-amine?
1-ethyl-3-(3-fluorophenyl)pyrazol-5-amine has a molecular weight of 205.24 g/mol, XLogP of 2.29, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-(3-fluorophenyl)pyrazol-5-amine is sourced from PubChem (CID 61265903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).