5-(4-fluorophenyl)-4-methoxy-1H-pyrazol-3-amine

C10H10FN3O — CID 134439842

IUPAC5-(4-fluorophenyl)-4-methoxy-1H-pyrazol-3-amine
SMILESCOc1c(N)n[nH]c1-c1ccc(F)cc1
InChIInChI=1S/C10H10FN3O/c1-15-9-8(13-14-10(9)12)6-2-4-7(11)5-3-6/h2-5H,1H3,(H3,12,13,14)
InChIKeyIVXAQEUTRMCUPH-UHFFFAOYSA-N
MW207.21 g/mol
LogP1.81
Rot. Bonds2

About 5-(4-fluorophenyl)-4-methoxy-1H-pyrazol-3-amine

5-(4-fluorophenyl)-4-methoxy-1H-pyrazol-3-amine (PubChem CID 134439842) has the molecular formula C10H10FN3O and a molecular weight of 207.21 g/mol. Its IUPAC name is 5-(4-fluorophenyl)-4-methoxy-1H-pyrazol-3-amine.

Molecular Properties

Compound Name5-(4-fluorophenyl)-4-methoxy-1H-pyrazol-3-amine
PubChem CID134439842
Molecular FormulaC10H10FN3O
Molecular Weight207.21 g/mol
Exact Mass207.08
IUPAC Name5-(4-fluorophenyl)-4-methoxy-1H-pyrazol-3-amine
SMILESCOc1c(N)n[nH]c1-c1ccc(F)cc1
InChIInChI=1S/C10H10FN3O/c1-15-9-8(13-14-10(9)12)6-2-4-7(11)5-3-6/h2-5H,1H3,(H3,12,13,14)
InChIKeyIVXAQEUTRMCUPH-UHFFFAOYSA-N
XLogP1.81
TPSA63.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.21
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(4-fluorophenyl)-4-methoxy-1H-pyrazol-3-amine?
The IUPAC name of 5-(4-fluorophenyl)-4-methoxy-1H-pyrazol-3-amine (CID 134439842) is 5-(4-fluorophenyl)-4-methoxy-1H-pyrazol-3-amine.
What is the SMILES notation for 5-(4-fluorophenyl)-4-methoxy-1H-pyrazol-3-amine?
The canonical SMILES for 5-(4-fluorophenyl)-4-methoxy-1H-pyrazol-3-amine is COc1c(N)n[nH]c1-c1ccc(F)cc1.
What is the InChIKey of 5-(4-fluorophenyl)-4-methoxy-1H-pyrazol-3-amine?
The InChIKey is IVXAQEUTRMCUPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FN3O/c1-15-9-8(13-14-10(9)12)6-2-4-7(11)5-3-6/h2-5H,1H3,(H3,12,13,14).
What are the key properties of 5-(4-fluorophenyl)-4-methoxy-1H-pyrazol-3-amine?
5-(4-fluorophenyl)-4-methoxy-1H-pyrazol-3-amine has a molecular weight of 207.21 g/mol, XLogP of 1.81, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorophenyl)-4-methoxy-1H-pyrazol-3-amine is sourced from PubChem (CID 134439842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).