[6-[(3R)-3,4-dimethylpiperazin-1-yl]-5-fluoro-2-methylpyrimidin-4-yl]hydrazine

C11H19FN6 — CID 66936099

IUPAC[6-[(3R)-3,4-dimethylpiperazin-1-yl]-5-fluoro-2-methylpyrimidin-4-yl]hydrazine
SMILESCc1nc(NN)c(F)c(N2CCN(C)[C@H](C)C2)n1
InChIInChI=1S/C11H19FN6/c1-7-6-18(5-4-17(7)3)11-9(12)10(16-13)14-8(2)15-11/h7H,4-6,13H2,1-3H3,(H,14,15,16)/t7-/m1/s1
InChIKeyGFWWJRKWHSNJHL-SSDOTTSWSA-N
MW254.31 g/mol
LogP0.35
Rot. Bonds2

About [6-[(3R)-3,4-dimethylpiperazin-1-yl]-5-fluoro-2-methylpyrimidin-4-yl]hydrazine

[6-[(3R)-3,4-dimethylpiperazin-1-yl]-5-fluoro-2-methylpyrimidin-4-yl]hydrazine (PubChem CID 66936099) has the molecular formula C11H19FN6 and a molecular weight of 254.31 g/mol. Its IUPAC name is [6-[(3R)-3,4-dimethylpiperazin-1-yl]-5-fluoro-2-methylpyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[6-[(3R)-3,4-dimethylpiperazin-1-yl]-5-fluoro-2-methylpyrimidin-4-yl]hydrazine
PubChem CID66936099
Molecular FormulaC11H19FN6
Molecular Weight254.31 g/mol
Exact Mass254.17
IUPAC Name[6-[(3R)-3,4-dimethylpiperazin-1-yl]-5-fluoro-2-methylpyrimidin-4-yl]hydrazine
SMILESCc1nc(NN)c(F)c(N2CCN(C)[C@H](C)C2)n1
InChIInChI=1S/C11H19FN6/c1-7-6-18(5-4-17(7)3)11-9(12)10(16-13)14-8(2)15-11/h7H,4-6,13H2,1-3H3,(H,14,15,16)/t7-/m1/s1
InChIKeyGFWWJRKWHSNJHL-SSDOTTSWSA-N
XLogP0.35
TPSA70.31 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.31
LogP ≤ 50.35
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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Frequently Asked Questions

What is the IUPAC name of [6-[(3R)-3,4-dimethylpiperazin-1-yl]-5-fluoro-2-methylpyrimidin-4-yl]hydrazine?
The IUPAC name of [6-[(3R)-3,4-dimethylpiperazin-1-yl]-5-fluoro-2-methylpyrimidin-4-yl]hydrazine (CID 66936099) is [6-[(3R)-3,4-dimethylpiperazin-1-yl]-5-fluoro-2-methylpyrimidin-4-yl]hydrazine.
What is the SMILES notation for [6-[(3R)-3,4-dimethylpiperazin-1-yl]-5-fluoro-2-methylpyrimidin-4-yl]hydrazine?
The canonical SMILES for [6-[(3R)-3,4-dimethylpiperazin-1-yl]-5-fluoro-2-methylpyrimidin-4-yl]hydrazine is Cc1nc(NN)c(F)c(N2CCN(C)[C@H](C)C2)n1.
What is the InChIKey of [6-[(3R)-3,4-dimethylpiperazin-1-yl]-5-fluoro-2-methylpyrimidin-4-yl]hydrazine?
The InChIKey is GFWWJRKWHSNJHL-SSDOTTSWSA-N. The full InChI is InChI=1S/C11H19FN6/c1-7-6-18(5-4-17(7)3)11-9(12)10(16-13)14-8(2)15-11/h7H,4-6,13H2,1-3H3,(H,14,15,16)/t7-/m1/s1.
What are the key properties of [6-[(3R)-3,4-dimethylpiperazin-1-yl]-5-fluoro-2-methylpyrimidin-4-yl]hydrazine?
[6-[(3R)-3,4-dimethylpiperazin-1-yl]-5-fluoro-2-methylpyrimidin-4-yl]hydrazine has a molecular weight of 254.31 g/mol, XLogP of 0.35, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[(3R)-3,4-dimethylpiperazin-1-yl]-5-fluoro-2-methylpyrimidin-4-yl]hydrazine is sourced from PubChem (CID 66936099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).