5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-amine

C14H11FN4 — CID 15513101

IUPAC5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-amine
SMILESNc1n[nH]c(-c2ccc(F)cc2)c1-c1ccncc1
InChIInChI=1S/C14H11FN4/c15-11-3-1-10(2-4-11)13-12(14(16)19-18-13)9-5-7-17-8-6-9/h1-8H,(H3,16,18,19)
InChIKeyRVZNYFIJKBEGRZ-UHFFFAOYSA-N
MW254.27 g/mol
LogP2.86
Rot. Bonds2

About 5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-amine

5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-amine (PubChem CID 15513101) has the molecular formula C14H11FN4 and a molecular weight of 254.27 g/mol. Its IUPAC name is 5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-amine.

Molecular Properties

Compound Name5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-amine
PubChem CID15513101
Molecular FormulaC14H11FN4
Molecular Weight254.27 g/mol
Exact Mass254.10
IUPAC Name5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-amine
SMILESNc1n[nH]c(-c2ccc(F)cc2)c1-c1ccncc1
InChIInChI=1S/C14H11FN4/c15-11-3-1-10(2-4-11)13-12(14(16)19-18-13)9-5-7-17-8-6-9/h1-8H,(H3,16,18,19)
InChIKeyRVZNYFIJKBEGRZ-UHFFFAOYSA-N
XLogP2.86
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.27
LogP ≤ 52.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-amine?
The IUPAC name of 5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-amine (CID 15513101) is 5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-amine.
What is the SMILES notation for 5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-amine?
The canonical SMILES for 5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-amine is Nc1n[nH]c(-c2ccc(F)cc2)c1-c1ccncc1.
What is the InChIKey of 5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-amine?
The InChIKey is RVZNYFIJKBEGRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11FN4/c15-11-3-1-10(2-4-11)13-12(14(16)19-18-13)9-5-7-17-8-6-9/h1-8H,(H3,16,18,19).
What are the key properties of 5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-amine?
5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-amine has a molecular weight of 254.27 g/mol, XLogP of 2.86, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-amine is sourced from PubChem (CID 15513101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).