[2-[(2,4-difluorophenyl)methyl]-5,6-dimethylpyrimidin-4-yl]hydrazine

C13H14F2N4 — CID 64559876

IUPAC[2-[(2,4-difluorophenyl)methyl]-5,6-dimethylpyrimidin-4-yl]hydrazine
SMILESCc1nc(Cc2ccc(F)cc2F)nc(NN)c1C
InChIInChI=1S/C13H14F2N4/c1-7-8(2)17-12(18-13(7)19-16)5-9-3-4-10(14)6-11(9)15/h3-4,6H,5,16H2,1-2H3,(H,17,18,19)
InChIKeyWYWYBMRPPHNLNU-UHFFFAOYSA-N
MW264.28 g/mol
LogP2.25
Rot. Bonds3

About [2-[(2,4-difluorophenyl)methyl]-5,6-dimethylpyrimidin-4-yl]hydrazine

[2-[(2,4-difluorophenyl)methyl]-5,6-dimethylpyrimidin-4-yl]hydrazine (PubChem CID 64559876) has the molecular formula C13H14F2N4 and a molecular weight of 264.28 g/mol. Its IUPAC name is [2-[(2,4-difluorophenyl)methyl]-5,6-dimethylpyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-[(2,4-difluorophenyl)methyl]-5,6-dimethylpyrimidin-4-yl]hydrazine
PubChem CID64559876
Molecular FormulaC13H14F2N4
Molecular Weight264.28 g/mol
Exact Mass264.12
IUPAC Name[2-[(2,4-difluorophenyl)methyl]-5,6-dimethylpyrimidin-4-yl]hydrazine
SMILESCc1nc(Cc2ccc(F)cc2F)nc(NN)c1C
InChIInChI=1S/C13H14F2N4/c1-7-8(2)17-12(18-13(7)19-16)5-9-3-4-10(14)6-11(9)15/h3-4,6H,5,16H2,1-2H3,(H,17,18,19)
InChIKeyWYWYBMRPPHNLNU-UHFFFAOYSA-N
XLogP2.25
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.28
LogP ≤ 52.25
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-[(2,4-difluorophenyl)methyl]-5,6-dimethylpyrimidin-4-yl]hydrazine?
The IUPAC name of [2-[(2,4-difluorophenyl)methyl]-5,6-dimethylpyrimidin-4-yl]hydrazine (CID 64559876) is [2-[(2,4-difluorophenyl)methyl]-5,6-dimethylpyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-[(2,4-difluorophenyl)methyl]-5,6-dimethylpyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-[(2,4-difluorophenyl)methyl]-5,6-dimethylpyrimidin-4-yl]hydrazine is Cc1nc(Cc2ccc(F)cc2F)nc(NN)c1C.
What is the InChIKey of [2-[(2,4-difluorophenyl)methyl]-5,6-dimethylpyrimidin-4-yl]hydrazine?
The InChIKey is WYWYBMRPPHNLNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14F2N4/c1-7-8(2)17-12(18-13(7)19-16)5-9-3-4-10(14)6-11(9)15/h3-4,6H,5,16H2,1-2H3,(H,17,18,19).
What are the key properties of [2-[(2,4-difluorophenyl)methyl]-5,6-dimethylpyrimidin-4-yl]hydrazine?
[2-[(2,4-difluorophenyl)methyl]-5,6-dimethylpyrimidin-4-yl]hydrazine has a molecular weight of 264.28 g/mol, XLogP of 2.25, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(2,4-difluorophenyl)methyl]-5,6-dimethylpyrimidin-4-yl]hydrazine is sourced from PubChem (CID 64559876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).