[2-(4-fluoro-3-methylphenyl)-6-propan-2-ylpyrimidin-4-yl]hydrazine

C14H17FN4 — CID 62251071

IUPAC[2-(4-fluoro-3-methylphenyl)-6-propan-2-ylpyrimidin-4-yl]hydrazine
SMILESCc1cc(-c2nc(NN)cc(C(C)C)n2)ccc1F
InChIInChI=1S/C14H17FN4/c1-8(2)12-7-13(19-16)18-14(17-12)10-4-5-11(15)9(3)6-10/h4-8H,16H2,1-3H3,(H,17,18,19)
InChIKeyYZMNXYLKTUFXGD-UHFFFAOYSA-N
MW260.32 g/mol
LogP3.00
Rot. Bonds3

About [2-(4-fluoro-3-methylphenyl)-6-propan-2-ylpyrimidin-4-yl]hydrazine

[2-(4-fluoro-3-methylphenyl)-6-propan-2-ylpyrimidin-4-yl]hydrazine (PubChem CID 62251071) has the molecular formula C14H17FN4 and a molecular weight of 260.32 g/mol. Its IUPAC name is [2-(4-fluoro-3-methylphenyl)-6-propan-2-ylpyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-(4-fluoro-3-methylphenyl)-6-propan-2-ylpyrimidin-4-yl]hydrazine
PubChem CID62251071
Molecular FormulaC14H17FN4
Molecular Weight260.32 g/mol
Exact Mass260.14
IUPAC Name[2-(4-fluoro-3-methylphenyl)-6-propan-2-ylpyrimidin-4-yl]hydrazine
SMILESCc1cc(-c2nc(NN)cc(C(C)C)n2)ccc1F
InChIInChI=1S/C14H17FN4/c1-8(2)12-7-13(19-16)18-14(17-12)10-4-5-11(15)9(3)6-10/h4-8H,16H2,1-3H3,(H,17,18,19)
InChIKeyYZMNXYLKTUFXGD-UHFFFAOYSA-N
XLogP3.00
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.32
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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 [2-(4-fluoro-3-methylphenyl)-6-propan-2-ylpyrimidin-4-yl]hydrazine?
The IUPAC name of [2-(4-fluoro-3-methylphenyl)-6-propan-2-ylpyrimidin-4-yl]hydrazine (CID 62251071) is [2-(4-fluoro-3-methylphenyl)-6-propan-2-ylpyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-(4-fluoro-3-methylphenyl)-6-propan-2-ylpyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-(4-fluoro-3-methylphenyl)-6-propan-2-ylpyrimidin-4-yl]hydrazine is Cc1cc(-c2nc(NN)cc(C(C)C)n2)ccc1F.
What is the InChIKey of [2-(4-fluoro-3-methylphenyl)-6-propan-2-ylpyrimidin-4-yl]hydrazine?
The InChIKey is YZMNXYLKTUFXGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17FN4/c1-8(2)12-7-13(19-16)18-14(17-12)10-4-5-11(15)9(3)6-10/h4-8H,16H2,1-3H3,(H,17,18,19).
What are the key properties of [2-(4-fluoro-3-methylphenyl)-6-propan-2-ylpyrimidin-4-yl]hydrazine?
[2-(4-fluoro-3-methylphenyl)-6-propan-2-ylpyrimidin-4-yl]hydrazine has a molecular weight of 260.32 g/mol, XLogP of 3.00, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-fluoro-3-methylphenyl)-6-propan-2-ylpyrimidin-4-yl]hydrazine is sourced from PubChem (CID 62251071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).