4-(2,6-difluoro-3-methylphenyl)-1H-pyrazol-5-amine

C10H9F2N3 — CID 117298239

IUPAC4-(2,6-difluoro-3-methylphenyl)-1H-pyrazol-5-amine
SMILESCc1ccc(F)c(-c2cn[nH]c2N)c1F
InChIInChI=1S/C10H9F2N3/c1-5-2-3-7(11)8(9(5)12)6-4-14-15-10(6)13/h2-4H,1H3,(H3,13,14,15)
InChIKeyJKYGHULUADUQAZ-UHFFFAOYSA-N
MW209.20 g/mol
LogP2.25
Rot. Bonds1

About 4-(2,6-difluoro-3-methylphenyl)-1H-pyrazol-5-amine

4-(2,6-difluoro-3-methylphenyl)-1H-pyrazol-5-amine (PubChem CID 117298239) has the molecular formula C10H9F2N3 and a molecular weight of 209.20 g/mol. Its IUPAC name is 4-(2,6-difluoro-3-methylphenyl)-1H-pyrazol-5-amine.

Molecular Properties

Compound Name4-(2,6-difluoro-3-methylphenyl)-1H-pyrazol-5-amine
PubChem CID117298239
Molecular FormulaC10H9F2N3
Molecular Weight209.20 g/mol
Exact Mass209.08
IUPAC Name4-(2,6-difluoro-3-methylphenyl)-1H-pyrazol-5-amine
SMILESCc1ccc(F)c(-c2cn[nH]c2N)c1F
InChIInChI=1S/C10H9F2N3/c1-5-2-3-7(11)8(9(5)12)6-4-14-15-10(6)13/h2-4H,1H3,(H3,13,14,15)
InChIKeyJKYGHULUADUQAZ-UHFFFAOYSA-N
XLogP2.25
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.20
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(5-amino-1H-pyrazol-4-yl)-3-fluoro-6-methylphenol
CID 117295542
4-(2,6-difluoro-3-methylsulfanylphenyl)-1H-pyrazol-5-amine
CID 117354762
4-(2,6-difluoro-3-methylsulfonylphenyl)-1H-pyrazol-5-amine
CID 117435379
4-(2-bromo-6-fluorophenyl)-1H-pyrazol-5-amine
CID 117393162
2-(5-amino-1H-pyrazol-4-yl)-3,4-dimethylphenol
CID 117291742
4-(6-chloro-2,3-dimethylphenyl)-1H-pyrazol-5-amine
CID 117317358
4-(3-chloro-2,4,6-trifluorophenyl)-1H-pyrazol-5-amine
CID 117372261
4-(6-bromo-3-fluoro-2-methoxyphenyl)-1H-pyrazol-5-amine
CID 117460558
4-(5-amino-1H-pyrazol-4-yl)-2-bromo-3,5-difluorophenol
CID 117468094
4-(3,5-difluoro-4-methylphenyl)-1H-pyrazol-5-amine
CID 117298238
4-(2,3,5-trifluoro-6-methoxyphenyl)-1H-pyrazol-5-amine
CID 117359088
4-(2-fluoro-4,5-dimethylthiophen-3-yl)-1H-pyrazol-5-amine
CID 70393584

Frequently Asked Questions

What is the IUPAC name of 4-(2,6-difluoro-3-methylphenyl)-1H-pyrazol-5-amine?
The IUPAC name of 4-(2,6-difluoro-3-methylphenyl)-1H-pyrazol-5-amine (CID 117298239) is 4-(2,6-difluoro-3-methylphenyl)-1H-pyrazol-5-amine.
What is the SMILES notation for 4-(2,6-difluoro-3-methylphenyl)-1H-pyrazol-5-amine?
The canonical SMILES for 4-(2,6-difluoro-3-methylphenyl)-1H-pyrazol-5-amine is Cc1ccc(F)c(-c2cn[nH]c2N)c1F.
What is the InChIKey of 4-(2,6-difluoro-3-methylphenyl)-1H-pyrazol-5-amine?
The InChIKey is JKYGHULUADUQAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9F2N3/c1-5-2-3-7(11)8(9(5)12)6-4-14-15-10(6)13/h2-4H,1H3,(H3,13,14,15).
What are the key properties of 4-(2,6-difluoro-3-methylphenyl)-1H-pyrazol-5-amine?
4-(2,6-difluoro-3-methylphenyl)-1H-pyrazol-5-amine has a molecular weight of 209.20 g/mol, XLogP of 2.25, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,6-difluoro-3-methylphenyl)-1H-pyrazol-5-amine is sourced from PubChem (CID 117298239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).