2-[1-(4-fluorophenyl)ethyl]pyrazol-3-amine

C11H12FN3 — CID 16785348

IUPAC2-[1-(4-fluorophenyl)ethyl]pyrazol-3-amine
SMILESCC(c1ccc(F)cc1)n1nccc1N
InChIInChI=1S/C11H12FN3/c1-8(15-11(13)6-7-14-15)9-2-4-10(12)5-3-9/h2-8H,13H2,1H3
InChIKeyNPLKYMSZVQVJAK-UHFFFAOYSA-N
MW205.24 g/mol
LogP2.21
Rot. Bonds2

About 2-[1-(4-fluorophenyl)ethyl]pyrazol-3-amine

2-[1-(4-fluorophenyl)ethyl]pyrazol-3-amine (PubChem CID 16785348) has the molecular formula C11H12FN3 and a molecular weight of 205.24 g/mol. Its IUPAC name is 2-[1-(4-fluorophenyl)ethyl]pyrazol-3-amine.

Molecular Properties

Compound Name2-[1-(4-fluorophenyl)ethyl]pyrazol-3-amine
PubChem CID16785348
Molecular FormulaC11H12FN3
Molecular Weight205.24 g/mol
Exact Mass205.10
IUPAC Name2-[1-(4-fluorophenyl)ethyl]pyrazol-3-amine
SMILESCC(c1ccc(F)cc1)n1nccc1N
InChIInChI=1S/C11H12FN3/c1-8(15-11(13)6-7-14-15)9-2-4-10(12)5-3-9/h2-8H,13H2,1H3
InChIKeyNPLKYMSZVQVJAK-UHFFFAOYSA-N
XLogP2.21
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 ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-(4-nitrophenyl)ethyl]pyrazol-3-amine
CID 16781407
2-[1-(3,4-dimethoxyphenyl)ethyl]pyrazol-3-amine
CID 3154159
2-[1-[2-(trifluoromethyl)phenyl]ethyl]pyrazol-3-amine
CID 16785799
2-[1-(2,5-dimethylfuran-3-yl)ethyl]pyrazol-3-amine
CID 43121456
1-[1-(4-fluorophenyl)ethyl]indazole
CID 173016436
2-(2-methyl-1-phenylpropyl)pyrazol-3-amine
CID 63193718
[1-[1-(4-fluorophenyl)ethyl]tetrazol-5-yl]methanamine
CID 62761163
1-[1-(4-fluorophenyl)ethyl]imidazol-4-amine
CID 139348686
1-(4-fluorophenyl)ethyl-trimethylsilane
CID 175460214
[1-[1-(4-fluorophenyl)ethyl]-3-methyl-5-pyrimidin-2-ylpyrazol-4-yl] formate
CID 54546334
1-[1-(4-fluorophenyl)ethyl]-4-propan-2-ylpiperazine
CID 174450752
1-fluoro-4-propan-2-ylbenzene;2-methylpropane
CID 177367696

Frequently Asked Questions

What is the IUPAC name of 2-[1-(4-fluorophenyl)ethyl]pyrazol-3-amine?
The IUPAC name of 2-[1-(4-fluorophenyl)ethyl]pyrazol-3-amine (CID 16785348) is 2-[1-(4-fluorophenyl)ethyl]pyrazol-3-amine.
What is the SMILES notation for 2-[1-(4-fluorophenyl)ethyl]pyrazol-3-amine?
The canonical SMILES for 2-[1-(4-fluorophenyl)ethyl]pyrazol-3-amine is CC(c1ccc(F)cc1)n1nccc1N.
What is the InChIKey of 2-[1-(4-fluorophenyl)ethyl]pyrazol-3-amine?
The InChIKey is NPLKYMSZVQVJAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12FN3/c1-8(15-11(13)6-7-14-15)9-2-4-10(12)5-3-9/h2-8H,13H2,1H3.
What are the key properties of 2-[1-(4-fluorophenyl)ethyl]pyrazol-3-amine?
2-[1-(4-fluorophenyl)ethyl]pyrazol-3-amine has a molecular weight of 205.24 g/mol, XLogP of 2.21, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(4-fluorophenyl)ethyl]pyrazol-3-amine is sourced from PubChem (CID 16785348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).