[6-[4-(4-fluorophenyl)piperazin-1-yl]pyrimidin-4-yl]hydrazine

C14H17FN6 — CID 80909931

IUPAC[6-[4-(4-fluorophenyl)piperazin-1-yl]pyrimidin-4-yl]hydrazine
SMILESNNc1cc(N2CCN(c3ccc(F)cc3)CC2)ncn1
InChIInChI=1S/C14H17FN6/c15-11-1-3-12(4-2-11)20-5-7-21(8-6-20)14-9-13(19-16)17-10-18-14/h1-4,9-10H,5-8,16H2,(H,17,18,19)
InChIKeySUZYNQAFJRQJHV-UHFFFAOYSA-N
MW288.33 g/mol
LogP1.23
Rot. Bonds3

About [6-[4-(4-fluorophenyl)piperazin-1-yl]pyrimidin-4-yl]hydrazine

[6-[4-(4-fluorophenyl)piperazin-1-yl]pyrimidin-4-yl]hydrazine (PubChem CID 80909931) has the molecular formula C14H17FN6 and a molecular weight of 288.33 g/mol. Its IUPAC name is [6-[4-(4-fluorophenyl)piperazin-1-yl]pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[6-[4-(4-fluorophenyl)piperazin-1-yl]pyrimidin-4-yl]hydrazine
PubChem CID80909931
Molecular FormulaC14H17FN6
Molecular Weight288.33 g/mol
Exact Mass288.15
IUPAC Name[6-[4-(4-fluorophenyl)piperazin-1-yl]pyrimidin-4-yl]hydrazine
SMILESNNc1cc(N2CCN(c3ccc(F)cc3)CC2)ncn1
InChIInChI=1S/C14H17FN6/c15-11-1-3-12(4-2-11)20-5-7-21(8-6-20)14-9-13(19-16)17-10-18-14/h1-4,9-10H,5-8,16H2,(H,17,18,19)
InChIKeySUZYNQAFJRQJHV-UHFFFAOYSA-N
XLogP1.23
TPSA70.31 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.33
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-cyclopropyl-6-[4-(4-fluorophenyl)piperazin-1-yl]pyrimidin-4-amine
CID 112854724
4-fluoro-6-[4-(4-fluorophenyl)piperazin-1-yl]pyrimidine
CID 115416249
N-[2-(4-fluorophenyl)ethyl]-6-[4-(4-fluorophenyl)piperazin-1-yl]pyrimidin-4-amine
CID 112861382
[6-[4-(3-chlorophenyl)piperazin-1-yl]pyrimidin-4-yl]hydrazine
CID 80909400
[6-(azepan-1-yl)pyrimidin-4-yl]hydrazine
CID 80927859
6-[4-(4-fluorophenyl)piperazin-1-yl]-N-(2-methoxyphenyl)pyrimidin-4-amine
CID 112862333
N-[(4-fluorophenyl)methyl]-6-(4-phenylpiperazin-1-yl)pyrimidin-4-amine
CID 112859720
6-[4-(4-fluorophenyl)piperazin-1-yl]-N-[(2-methylphenyl)methyl]pyrimidin-4-amine
CID 112858906
1-[4-[[6-[4-(4-fluorophenyl)piperazin-1-yl]pyrimidin-4-yl]amino]phenyl]ethanone
CID 112862340
N-(1,3-benzodioxol-5-yl)-6-[4-(4-fluorophenyl)piperazin-1-yl]pyrimidin-4-amine
CID 112862343
[6-(4-methylsulfonylpiperazin-1-yl)pyrimidin-4-yl]hydrazine
CID 80914226
N-methyl-6-(4-phenylpiperazin-1-yl)pyrimidin-4-amine
CID 80754206

Frequently Asked Questions

What is the IUPAC name of [6-[4-(4-fluorophenyl)piperazin-1-yl]pyrimidin-4-yl]hydrazine?
The IUPAC name of [6-[4-(4-fluorophenyl)piperazin-1-yl]pyrimidin-4-yl]hydrazine (CID 80909931) is [6-[4-(4-fluorophenyl)piperazin-1-yl]pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [6-[4-(4-fluorophenyl)piperazin-1-yl]pyrimidin-4-yl]hydrazine?
The canonical SMILES for [6-[4-(4-fluorophenyl)piperazin-1-yl]pyrimidin-4-yl]hydrazine is NNc1cc(N2CCN(c3ccc(F)cc3)CC2)ncn1.
What is the InChIKey of [6-[4-(4-fluorophenyl)piperazin-1-yl]pyrimidin-4-yl]hydrazine?
The InChIKey is SUZYNQAFJRQJHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17FN6/c15-11-1-3-12(4-2-11)20-5-7-21(8-6-20)14-9-13(19-16)17-10-18-14/h1-4,9-10H,5-8,16H2,(H,17,18,19).
What are the key properties of [6-[4-(4-fluorophenyl)piperazin-1-yl]pyrimidin-4-yl]hydrazine?
[6-[4-(4-fluorophenyl)piperazin-1-yl]pyrimidin-4-yl]hydrazine has a molecular weight of 288.33 g/mol, XLogP of 1.23, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[4-(4-fluorophenyl)piperazin-1-yl]pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 80909931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).