1-[5-(3-fluorophenyl)-4-methyl-1H-pyrazol-3-yl]piperidin-3-amine

C15H19FN4 — CID 114872947

IUPAC1-[5-(3-fluorophenyl)-4-methyl-1H-pyrazol-3-yl]piperidin-3-amine
SMILESCc1c(N2CCCC(N)C2)n[nH]c1-c1cccc(F)c1
InChIInChI=1S/C15H19FN4/c1-10-14(11-4-2-5-12(16)8-11)18-19-15(10)20-7-3-6-13(17)9-20/h2,4-5,8,13H,3,6-7,9,17H2,1H3,(H,18,19)
InChIKeyKQFRYTXFIIROKO-UHFFFAOYSA-N
MW274.34 g/mol
LogP2.45
Rot. Bonds2

About 1-[5-(3-fluorophenyl)-4-methyl-1H-pyrazol-3-yl]piperidin-3-amine

1-[5-(3-fluorophenyl)-4-methyl-1H-pyrazol-3-yl]piperidin-3-amine (PubChem CID 114872947) has the molecular formula C15H19FN4 and a molecular weight of 274.34 g/mol. Its IUPAC name is 1-[5-(3-fluorophenyl)-4-methyl-1H-pyrazol-3-yl]piperidin-3-amine.

Molecular Properties

Compound Name1-[5-(3-fluorophenyl)-4-methyl-1H-pyrazol-3-yl]piperidin-3-amine
PubChem CID114872947
Molecular FormulaC15H19FN4
Molecular Weight274.34 g/mol
Exact Mass274.16
IUPAC Name1-[5-(3-fluorophenyl)-4-methyl-1H-pyrazol-3-yl]piperidin-3-amine
SMILESCc1c(N2CCCC(N)C2)n[nH]c1-c1cccc(F)c1
InChIInChI=1S/C15H19FN4/c1-10-14(11-4-2-5-12(16)8-11)18-19-15(10)20-7-3-6-13(17)9-20/h2,4-5,8,13H,3,6-7,9,17H2,1H3,(H,18,19)
InChIKeyKQFRYTXFIIROKO-UHFFFAOYSA-N
XLogP2.45
TPSA57.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.34
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[5-(4-ethylphenyl)-4-methyl-1H-pyrazol-3-yl]pyrrolidin-3-amine
CID 114697594
1-(4-fluoro-2-methylphenyl)piperidin-3-amine
CID 54594111
1-[5-(3-methoxyphenyl)-1H-pyrazol-3-yl]piperidin-3-amine
CID 56771509
1-[5-(2-chloro-4-fluorophenyl)-1H-pyrazol-3-yl]piperidin-3-amine
CID 114697799
1-(3-methyl-2-pyridinyl)piperidin-3-amine
CID 62253167
1-[1-[5-(3-fluorophenyl)-1H-1,2,4-triazol-3-yl]piperidin-3-yl]-N-methylmethanamine
CID 102799712
(3R)-1-[(3-fluorophenyl)methyl]piperidin-3-amine
CID 24904616
N-[1-[6-(3-fluorophenyl)-4-methylpyridazin-3-yl]piperidin-3-yl]acetamide
CID 71862457
1-[5-(2-chloro-6-fluorophenyl)-1H-1,2,4-triazol-3-yl]piperidin-3-amine
CID 102794407
1-[[3-(3-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-3-amine
CID 56770209
1-[5-(3-bromo-4-fluorophenyl)-1H-pyrazol-3-yl]piperidin-3-amine
CID 114697836
1-[5-(2,3-difluorophenyl)-1H-1,2,4-triazol-3-yl]piperidin-3-amine
CID 102794171

Frequently Asked Questions

What is the IUPAC name of 1-[5-(3-fluorophenyl)-4-methyl-1H-pyrazol-3-yl]piperidin-3-amine?
The IUPAC name of 1-[5-(3-fluorophenyl)-4-methyl-1H-pyrazol-3-yl]piperidin-3-amine (CID 114872947) is 1-[5-(3-fluorophenyl)-4-methyl-1H-pyrazol-3-yl]piperidin-3-amine.
What is the SMILES notation for 1-[5-(3-fluorophenyl)-4-methyl-1H-pyrazol-3-yl]piperidin-3-amine?
The canonical SMILES for 1-[5-(3-fluorophenyl)-4-methyl-1H-pyrazol-3-yl]piperidin-3-amine is Cc1c(N2CCCC(N)C2)n[nH]c1-c1cccc(F)c1.
What is the InChIKey of 1-[5-(3-fluorophenyl)-4-methyl-1H-pyrazol-3-yl]piperidin-3-amine?
The InChIKey is KQFRYTXFIIROKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN4/c1-10-14(11-4-2-5-12(16)8-11)18-19-15(10)20-7-3-6-13(17)9-20/h2,4-5,8,13H,3,6-7,9,17H2,1H3,(H,18,19).
What are the key properties of 1-[5-(3-fluorophenyl)-4-methyl-1H-pyrazol-3-yl]piperidin-3-amine?
1-[5-(3-fluorophenyl)-4-methyl-1H-pyrazol-3-yl]piperidin-3-amine has a molecular weight of 274.34 g/mol, XLogP of 2.45, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(3-fluorophenyl)-4-methyl-1H-pyrazol-3-yl]piperidin-3-amine is sourced from PubChem (CID 114872947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).