5-[4-[6-(4-fluorophenyl)pyridazin-3-yl]piperazin-1-yl]pyridin-2-amine

C19H19FN6 — CID 133304096

IUPAC5-[4-[6-(4-fluorophenyl)pyridazin-3-yl]piperazin-1-yl]pyridin-2-amine
SMILESNc1ccc(N2CCN(c3ccc(-c4ccc(F)cc4)nn3)CC2)cn1
InChIInChI=1S/C19H19FN6/c20-15-3-1-14(2-4-15)17-6-8-19(24-23-17)26-11-9-25(10-12-26)16-5-7-18(21)22-13-16/h1-8,13H,9-12H2,(H2,21,22)
InChIKeyCLJQNUSACSCYRX-UHFFFAOYSA-N
MW350.40 g/mol
LogP2.59
Rot. Bonds3

About 5-[4-[6-(4-fluorophenyl)pyridazin-3-yl]piperazin-1-yl]pyridin-2-amine

5-[4-[6-(4-fluorophenyl)pyridazin-3-yl]piperazin-1-yl]pyridin-2-amine (PubChem CID 133304096) has the molecular formula C19H19FN6 and a molecular weight of 350.40 g/mol. Its IUPAC name is 5-[4-[6-(4-fluorophenyl)pyridazin-3-yl]piperazin-1-yl]pyridin-2-amine.

Molecular Properties

Compound Name5-[4-[6-(4-fluorophenyl)pyridazin-3-yl]piperazin-1-yl]pyridin-2-amine
PubChem CID133304096
Molecular FormulaC19H19FN6
Molecular Weight350.40 g/mol
Exact Mass350.17
IUPAC Name5-[4-[6-(4-fluorophenyl)pyridazin-3-yl]piperazin-1-yl]pyridin-2-amine
SMILESNc1ccc(N2CCN(c3ccc(-c4ccc(F)cc4)nn3)CC2)cn1
InChIInChI=1S/C19H19FN6/c20-15-3-1-14(2-4-15)17-6-8-19(24-23-17)26-11-9-25(10-12-26)16-5-7-18(21)22-13-16/h1-8,13H,9-12H2,(H2,21,22)
InChIKeyCLJQNUSACSCYRX-UHFFFAOYSA-N
XLogP2.59
TPSA71.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.40
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-[6-(4-fluorophenyl)pyridazin-3-yl]piperidin-4-amine
CID 56770269
2-[4-[6-(4-fluorophenyl)pyridazin-3-yl]piperazin-1-yl]quinoxaline
CID 108776824
5-[4-(5-chloro-2-pyridinyl)piperazin-1-yl]pyridin-2-amine
CID 60870212
6-(4-fluorophenyl)pyridazin-3-amine
CID 11030588
1-[6-(4-fluorophenyl)pyridazin-3-yl]pyrrolidin-3-ol
CID 56770273
5-(5-morpholin-4-yl-2-pyridinyl)pyridin-2-amine
CID 172791169
1-[6-(4-fluorophenyl)pyridazin-3-yl]-4-propyl-1,4-diazepane
CID 133314322
4-(6-piperidin-1-ylpyridazin-3-yl)aniline
CID 51711955
5-[4-(6-methoxypyrimidin-4-yl)piperazin-1-yl]pyridin-2-amine
CID 66318979
3-(4-cyclohexyloxypiperidin-1-yl)-6-(4-fluorophenyl)pyridazine
CID 133278346
5-[4-(4-chlorophenyl)piperazin-1-yl]pyridin-2-amine
CID 43318150
5-(azepan-1-yl)pyridin-2-amine;dihydrochloride
CID 75537462

Frequently Asked Questions

What is the IUPAC name of 5-[4-[6-(4-fluorophenyl)pyridazin-3-yl]piperazin-1-yl]pyridin-2-amine?
The IUPAC name of 5-[4-[6-(4-fluorophenyl)pyridazin-3-yl]piperazin-1-yl]pyridin-2-amine (CID 133304096) is 5-[4-[6-(4-fluorophenyl)pyridazin-3-yl]piperazin-1-yl]pyridin-2-amine.
What is the SMILES notation for 5-[4-[6-(4-fluorophenyl)pyridazin-3-yl]piperazin-1-yl]pyridin-2-amine?
The canonical SMILES for 5-[4-[6-(4-fluorophenyl)pyridazin-3-yl]piperazin-1-yl]pyridin-2-amine is Nc1ccc(N2CCN(c3ccc(-c4ccc(F)cc4)nn3)CC2)cn1.
What is the InChIKey of 5-[4-[6-(4-fluorophenyl)pyridazin-3-yl]piperazin-1-yl]pyridin-2-amine?
The InChIKey is CLJQNUSACSCYRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19FN6/c20-15-3-1-14(2-4-15)17-6-8-19(24-23-17)26-11-9-25(10-12-26)16-5-7-18(21)22-13-16/h1-8,13H,9-12H2,(H2,21,22).
What are the key properties of 5-[4-[6-(4-fluorophenyl)pyridazin-3-yl]piperazin-1-yl]pyridin-2-amine?
5-[4-[6-(4-fluorophenyl)pyridazin-3-yl]piperazin-1-yl]pyridin-2-amine has a molecular weight of 350.40 g/mol, XLogP of 2.59, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-[6-(4-fluorophenyl)pyridazin-3-yl]piperazin-1-yl]pyridin-2-amine is sourced from PubChem (CID 133304096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).