N-[4-(4-fluorophenyl)phenyl]-2,5-dimethylpyrazol-3-amine

C17H16FN3 — CID 11652073

IUPACN-[4-(4-fluorophenyl)phenyl]-2,5-dimethylpyrazol-3-amine
SMILESCc1cc(Nc2ccc(-c3ccc(F)cc3)cc2)n(C)n1
InChIInChI=1S/C17H16FN3/c1-12-11-17(21(2)20-12)19-16-9-5-14(6-10-16)13-3-7-15(18)8-4-13/h3-11,19H,1-2H3
InChIKeyOZZLRMULRCPYPO-UHFFFAOYSA-N
MW281.33 g/mol
LogP4.28
Rot. Bonds3

About N-[4-(4-fluorophenyl)phenyl]-2,5-dimethylpyrazol-3-amine

N-[4-(4-fluorophenyl)phenyl]-2,5-dimethylpyrazol-3-amine (PubChem CID 11652073) has the molecular formula C17H16FN3 and a molecular weight of 281.33 g/mol. Its IUPAC name is N-[4-(4-fluorophenyl)phenyl]-2,5-dimethylpyrazol-3-amine.

Molecular Properties

Compound NameN-[4-(4-fluorophenyl)phenyl]-2,5-dimethylpyrazol-3-amine
PubChem CID11652073
Molecular FormulaC17H16FN3
Molecular Weight281.33 g/mol
Exact Mass281.13
IUPAC NameN-[4-(4-fluorophenyl)phenyl]-2,5-dimethylpyrazol-3-amine
SMILESCc1cc(Nc2ccc(-c3ccc(F)cc3)cc2)n(C)n1
InChIInChI=1S/C17H16FN3/c1-12-11-17(21(2)20-12)19-16-9-5-14(6-10-16)13-3-7-15(18)8-4-13/h3-11,19H,1-2H3
InChIKeyOZZLRMULRCPYPO-UHFFFAOYSA-N
XLogP4.28
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.33
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Pyrazole, 5-amino-3-(p-aminophenyl)-1-phenyl-
CID 202779
1-benzyl-3-methyl-1H-pyrazol-5-amine
CID 769146
3-Methyl-1,4-diphenyl-1H-pyrazol-5-amine
CID 619285
1,3-Diphenyl-1H-pyrazol-5-amine
CID 199969
1-(4-Fluorophenyl)-3-(4-methylphenyl)-1H-pyrazol-5-amine
CID 1478026
3-(3-Methylphenyl)-1-phenyl-1H-pyrazol-5-ylamine
CID 2060622
3-(4-ethylphenyl)-1-phenyl-1H-pyrazol-5-amine
CID 2517678
1-benzyl-3-phenyl-1H-pyrazol-5-amine
CID 684746
1H-Pyrazol-5-amine, 3-methyl-1-(4-methylphenyl)-
CID 112855
N-(3-fluoro-4-methylphenyl)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 653193
1-(4-Fluorophenyl)-3-[4-(4-fluorophenyl)-2-methyl-5-(trifluoromethyl)-3-pyrazolyl]urea
CID 2810695
N-(4-isopropylphenyl)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CID 5308416

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-fluorophenyl)phenyl]-2,5-dimethylpyrazol-3-amine?
The IUPAC name of N-[4-(4-fluorophenyl)phenyl]-2,5-dimethylpyrazol-3-amine (CID 11652073) is N-[4-(4-fluorophenyl)phenyl]-2,5-dimethylpyrazol-3-amine.
What is the SMILES notation for N-[4-(4-fluorophenyl)phenyl]-2,5-dimethylpyrazol-3-amine?
The canonical SMILES for N-[4-(4-fluorophenyl)phenyl]-2,5-dimethylpyrazol-3-amine is Cc1cc(Nc2ccc(-c3ccc(F)cc3)cc2)n(C)n1.
What is the InChIKey of N-[4-(4-fluorophenyl)phenyl]-2,5-dimethylpyrazol-3-amine?
The InChIKey is OZZLRMULRCPYPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16FN3/c1-12-11-17(21(2)20-12)19-16-9-5-14(6-10-16)13-3-7-15(18)8-4-13/h3-11,19H,1-2H3.
What are the key properties of N-[4-(4-fluorophenyl)phenyl]-2,5-dimethylpyrazol-3-amine?
N-[4-(4-fluorophenyl)phenyl]-2,5-dimethylpyrazol-3-amine has a molecular weight of 281.33 g/mol, XLogP of 4.28, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-fluorophenyl)phenyl]-2,5-dimethylpyrazol-3-amine is sourced from PubChem (CID 11652073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).