1-(2-fluorophenyl)-3-propylpyrazol-5-amine

C12H14FN3 — CID 82079514

IUPAC1-(2-fluorophenyl)-3-propylpyrazol-5-amine
SMILESCCCc1cc(N)n(-c2ccccc2F)n1
InChIInChI=1S/C12H14FN3/c1-2-5-9-8-12(14)16(15-9)11-7-4-3-6-10(11)13/h3-4,6-8H,2,5,14H2,1H3
InChIKeyJPSHSJSMJPSDPB-UHFFFAOYSA-N
MW219.26 g/mol
LogP2.55
Rot. Bonds3

About 1-(2-fluorophenyl)-3-propylpyrazol-5-amine

1-(2-fluorophenyl)-3-propylpyrazol-5-amine (PubChem CID 82079514) has the molecular formula C12H14FN3 and a molecular weight of 219.26 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-3-propylpyrazol-5-amine.

Molecular Properties

Compound Name1-(2-fluorophenyl)-3-propylpyrazol-5-amine
PubChem CID82079514
Molecular FormulaC12H14FN3
Molecular Weight219.26 g/mol
Exact Mass219.12
IUPAC Name1-(2-fluorophenyl)-3-propylpyrazol-5-amine
SMILESCCCc1cc(N)n(-c2ccccc2F)n1
InChIInChI=1S/C12H14FN3/c1-2-5-9-8-12(14)16(15-9)11-7-4-3-6-10(11)13/h3-4,6-8H,2,5,14H2,1H3
InChIKeyJPSHSJSMJPSDPB-UHFFFAOYSA-N
XLogP2.55
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.26
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-1-(2-fluorophenyl)-3-propylpyrazole
CID 66020942
2-[1-(2-fluorophenyl)-3-propylpyrazol-5-yl]sulfanylacetic acid
CID 62407977
1-(4-chlorophenyl)-3-propylpyrazol-5-amine
CID 82083521
1-(2-bromophenyl)-3-ethylpyrazol-5-amine
CID 82091920
1-(4-tert-butylphenyl)-3-propylpyrazol-5-amine
CID 82089365
3-butyl-1-(4-fluorophenyl)pyrazol-5-amine
CID 82082766
3-heptyl-1-phenylpyrazol-5-amine
CID 43336725
3-(chloromethyl)-1-(2-fluorophenyl)-5-methylpyrazole
CID 82128124
2-[1-(2-fluorophenyl)-3,5-dimethylpyrazol-4-yl]propan-1-amine
CID 79218757
1-(3-bromo-4-methylphenyl)-3-propylpyrazol-5-amine
CID 82094414
5-chloro-1-(2-methylphenyl)-3-propylpyrazole
CID 66022394
3-[2-(2-fluorophenyl)ethyl]-1-methylpyrazol-5-amine
CID 82079512

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-3-propylpyrazol-5-amine?
The IUPAC name of 1-(2-fluorophenyl)-3-propylpyrazol-5-amine (CID 82079514) is 1-(2-fluorophenyl)-3-propylpyrazol-5-amine.
What is the SMILES notation for 1-(2-fluorophenyl)-3-propylpyrazol-5-amine?
The canonical SMILES for 1-(2-fluorophenyl)-3-propylpyrazol-5-amine is CCCc1cc(N)n(-c2ccccc2F)n1.
What is the InChIKey of 1-(2-fluorophenyl)-3-propylpyrazol-5-amine?
The InChIKey is JPSHSJSMJPSDPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14FN3/c1-2-5-9-8-12(14)16(15-9)11-7-4-3-6-10(11)13/h3-4,6-8H,2,5,14H2,1H3.
What are the key properties of 1-(2-fluorophenyl)-3-propylpyrazol-5-amine?
1-(2-fluorophenyl)-3-propylpyrazol-5-amine has a molecular weight of 219.26 g/mol, XLogP of 2.55, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-3-propylpyrazol-5-amine is sourced from PubChem (CID 82079514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).