1-(3-fluoro-5-methylphenyl)-5-methylpyrazol-3-amine

C11H12FN3 — CID 102942937

IUPAC1-(3-fluoro-5-methylphenyl)-5-methylpyrazol-3-amine
SMILESCc1cc(F)cc(-n2nc(N)cc2C)c1
InChIInChI=1S/C11H12FN3/c1-7-3-9(12)6-10(4-7)15-8(2)5-11(13)14-15/h3-6H,1-2H3,(H2,13,14)
InChIKeyDPCMRQMOIGDLRX-UHFFFAOYSA-N
MW205.24 g/mol
LogP2.21
Rot. Bonds1

About 1-(3-fluoro-5-methylphenyl)-5-methylpyrazol-3-amine

1-(3-fluoro-5-methylphenyl)-5-methylpyrazol-3-amine (PubChem CID 102942937) has the molecular formula C11H12FN3 and a molecular weight of 205.24 g/mol. Its IUPAC name is 1-(3-fluoro-5-methylphenyl)-5-methylpyrazol-3-amine.

Molecular Properties

Compound Name1-(3-fluoro-5-methylphenyl)-5-methylpyrazol-3-amine
PubChem CID102942937
Molecular FormulaC11H12FN3
Molecular Weight205.24 g/mol
Exact Mass205.10
IUPAC Name1-(3-fluoro-5-methylphenyl)-5-methylpyrazol-3-amine
SMILESCc1cc(F)cc(-n2nc(N)cc2C)c1
InChIInChI=1S/C11H12FN3/c1-7-3-9(12)6-10(4-7)15-8(2)5-11(13)14-15/h3-6H,1-2H3,(H2,13,14)
InChIKeyDPCMRQMOIGDLRX-UHFFFAOYSA-N
XLogP2.21
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
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

1-(3-fluoro-5-nitrophenyl)-5-methylpyrazol-3-amine
CID 107335746
1-(2,4-difluorophenyl)-5-methylpyrazol-3-amine
CID 42692484
1-(3,5-dimethylphenyl)-3,5-dimethylpyrazole
CID 39240351
1-(2,4-dimethylphenyl)-5-methylpyrazol-3-amine
CID 62679820
5-methyl-1-(4-phenylphenyl)pyrazol-3-amine
CID 102942821
4-(3-amino-5-methylpyrazol-1-yl)benzonitrile
CID 46705137
1-(4-fluoro-3-nitrophenyl)-5-methylpyrazol-3-amine
CID 102942610
5-methyl-1-(4-nitrophenyl)pyrazol-3-amine
CID 50999869
1-(1,5-dimethylpyrazol-3-yl)-5-methylpyrazol-3-amine
CID 130497130
2-(3-amino-5-methylpyrazol-1-yl)-5-fluorobenzamide
CID 114253378
3-[1-(3-fluoro-5-methylphenyl)tetrazol-5-yl]-4-methylaniline
CID 79047538
1-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-5-methylpyrazol-3-amine
CID 126850275

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluoro-5-methylphenyl)-5-methylpyrazol-3-amine?
The IUPAC name of 1-(3-fluoro-5-methylphenyl)-5-methylpyrazol-3-amine (CID 102942937) is 1-(3-fluoro-5-methylphenyl)-5-methylpyrazol-3-amine.
What is the SMILES notation for 1-(3-fluoro-5-methylphenyl)-5-methylpyrazol-3-amine?
The canonical SMILES for 1-(3-fluoro-5-methylphenyl)-5-methylpyrazol-3-amine is Cc1cc(F)cc(-n2nc(N)cc2C)c1.
What is the InChIKey of 1-(3-fluoro-5-methylphenyl)-5-methylpyrazol-3-amine?
The InChIKey is DPCMRQMOIGDLRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12FN3/c1-7-3-9(12)6-10(4-7)15-8(2)5-11(13)14-15/h3-6H,1-2H3,(H2,13,14).
What are the key properties of 1-(3-fluoro-5-methylphenyl)-5-methylpyrazol-3-amine?
1-(3-fluoro-5-methylphenyl)-5-methylpyrazol-3-amine has a molecular weight of 205.24 g/mol, XLogP of 2.21, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluoro-5-methylphenyl)-5-methylpyrazol-3-amine is sourced from PubChem (CID 102942937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).