5-(5-fluoro-3-pyridinyl)-4-(3-methoxyphenyl)-1H-pyrazol-3-amine

C15H13FN4O — CID 104785968

IUPAC5-(5-fluoro-3-pyridinyl)-4-(3-methoxyphenyl)-1H-pyrazol-3-amine
SMILESCOc1cccc(-c2c(N)n[nH]c2-c2cncc(F)c2)c1
InChIInChI=1S/C15H13FN4O/c1-21-12-4-2-3-9(6-12)13-14(19-20-15(13)17)10-5-11(16)8-18-7-10/h2-8H,1H3,(H3,17,19,20)
InChIKeyVUXCROFBIAHUNN-UHFFFAOYSA-N
MW284.29 g/mol
LogP2.87
Rot. Bonds3

About 5-(5-fluoro-3-pyridinyl)-4-(3-methoxyphenyl)-1H-pyrazol-3-amine

5-(5-fluoro-3-pyridinyl)-4-(3-methoxyphenyl)-1H-pyrazol-3-amine (PubChem CID 104785968) has the molecular formula C15H13FN4O and a molecular weight of 284.29 g/mol. Its IUPAC name is 5-(5-fluoro-3-pyridinyl)-4-(3-methoxyphenyl)-1H-pyrazol-3-amine.

Molecular Properties

Compound Name5-(5-fluoro-3-pyridinyl)-4-(3-methoxyphenyl)-1H-pyrazol-3-amine
PubChem CID104785968
Molecular FormulaC15H13FN4O
Molecular Weight284.29 g/mol
Exact Mass284.11
IUPAC Name5-(5-fluoro-3-pyridinyl)-4-(3-methoxyphenyl)-1H-pyrazol-3-amine
SMILESCOc1cccc(-c2c(N)n[nH]c2-c2cncc(F)c2)c1
InChIInChI=1S/C15H13FN4O/c1-21-12-4-2-3-9(6-12)13-14(19-20-15(13)17)10-5-11(16)8-18-7-10/h2-8H,1H3,(H3,17,19,20)
InChIKeyVUXCROFBIAHUNN-UHFFFAOYSA-N
XLogP2.87
TPSA76.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.29
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(4-fluorophenyl)-4-(3-methoxyphenyl)-1H-pyrazol-3-amine
CID 61261996
5-(5-fluoro-2-pyridinyl)-4-(3-methoxyphenyl)-1H-pyrazol-3-amine
CID 104638670
4-(3,4-dichlorophenyl)-5-(5-fluoro-3-pyridinyl)-1H-pyrazol-3-amine
CID 104785975
5-(5-fluoro-3-pyridinyl)-4-(2-methylphenyl)-1H-pyrazol-3-amine
CID 104785937
5-(4,5-dibromothiophen-2-yl)-4-(3-methoxyphenyl)-1H-pyrazol-3-amine
CID 80534161
5-(3-chlorothiophen-2-yl)-4-(3-methoxyphenyl)-1H-pyrazol-3-amine
CID 80644815
4-(3,4-dimethylphenyl)-5-(3-fluorophenyl)-1H-pyrazol-3-amine
CID 62901471
4-(3-fluorophenyl)-5-(3-methoxyphenyl)-1H-pyrazolo[3,4-c]pyridazin-3-amine
CID 85068853
4-(3-fluorophenyl)-5-(5-methylfuran-3-yl)-1H-pyrazol-3-amine
CID 114821031
4-(3-methoxy-4-methylphenyl)-5-pyrimidin-5-yl-1H-pyrazol-3-amine
CID 102921933
4-(3-methoxyphenyl)-5-(2,2,3,3-tetramethylcyclopropyl)-1H-pyrazol-3-amine
CID 66477859
3,5-difluoro-4-(3-methoxyphenyl)aniline
CID 175669991

Frequently Asked Questions

What is the IUPAC name of 5-(5-fluoro-3-pyridinyl)-4-(3-methoxyphenyl)-1H-pyrazol-3-amine?
The IUPAC name of 5-(5-fluoro-3-pyridinyl)-4-(3-methoxyphenyl)-1H-pyrazol-3-amine (CID 104785968) is 5-(5-fluoro-3-pyridinyl)-4-(3-methoxyphenyl)-1H-pyrazol-3-amine.
What is the SMILES notation for 5-(5-fluoro-3-pyridinyl)-4-(3-methoxyphenyl)-1H-pyrazol-3-amine?
The canonical SMILES for 5-(5-fluoro-3-pyridinyl)-4-(3-methoxyphenyl)-1H-pyrazol-3-amine is COc1cccc(-c2c(N)n[nH]c2-c2cncc(F)c2)c1.
What is the InChIKey of 5-(5-fluoro-3-pyridinyl)-4-(3-methoxyphenyl)-1H-pyrazol-3-amine?
The InChIKey is VUXCROFBIAHUNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FN4O/c1-21-12-4-2-3-9(6-12)13-14(19-20-15(13)17)10-5-11(16)8-18-7-10/h2-8H,1H3,(H3,17,19,20).
What are the key properties of 5-(5-fluoro-3-pyridinyl)-4-(3-methoxyphenyl)-1H-pyrazol-3-amine?
5-(5-fluoro-3-pyridinyl)-4-(3-methoxyphenyl)-1H-pyrazol-3-amine has a molecular weight of 284.29 g/mol, XLogP of 2.87, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-fluoro-3-pyridinyl)-4-(3-methoxyphenyl)-1H-pyrazol-3-amine is sourced from PubChem (CID 104785968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).