[6-ethyl-2-(5-fluoro-2-pyridinyl)-5-methylpyrimidin-4-yl]hydrazine

C12H14FN5 — CID 79718877

IUPAC[6-ethyl-2-(5-fluoro-2-pyridinyl)-5-methylpyrimidin-4-yl]hydrazine
SMILESCCc1nc(-c2ccc(F)cn2)nc(NN)c1C
InChIInChI=1S/C12H14FN5/c1-3-9-7(2)11(18-14)17-12(16-9)10-5-4-8(13)6-15-10/h4-6H,3,14H2,1-2H3,(H,16,17,18)
InChIKeyBPPSYZRIAYGCPD-UHFFFAOYSA-N
MW247.28 g/mol
LogP1.83
Rot. Bonds3

About [6-ethyl-2-(5-fluoro-2-pyridinyl)-5-methylpyrimidin-4-yl]hydrazine

[6-ethyl-2-(5-fluoro-2-pyridinyl)-5-methylpyrimidin-4-yl]hydrazine (PubChem CID 79718877) has the molecular formula C12H14FN5 and a molecular weight of 247.28 g/mol. Its IUPAC name is [6-ethyl-2-(5-fluoro-2-pyridinyl)-5-methylpyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[6-ethyl-2-(5-fluoro-2-pyridinyl)-5-methylpyrimidin-4-yl]hydrazine
PubChem CID79718877
Molecular FormulaC12H14FN5
Molecular Weight247.28 g/mol
Exact Mass247.12
IUPAC Name[6-ethyl-2-(5-fluoro-2-pyridinyl)-5-methylpyrimidin-4-yl]hydrazine
SMILESCCc1nc(-c2ccc(F)cn2)nc(NN)c1C
InChIInChI=1S/C12H14FN5/c1-3-9-7(2)11(18-14)17-12(16-9)10-5-4-8(13)6-15-10/h4-6H,3,14H2,1-2H3,(H,16,17,18)
InChIKeyBPPSYZRIAYGCPD-UHFFFAOYSA-N
XLogP1.83
TPSA76.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.28
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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-ethyl-2-(5-fluoro-2-pyridinyl)-5-methylpyrimidin-4-yl]hydrazine?
The IUPAC name of [6-ethyl-2-(5-fluoro-2-pyridinyl)-5-methylpyrimidin-4-yl]hydrazine (CID 79718877) is [6-ethyl-2-(5-fluoro-2-pyridinyl)-5-methylpyrimidin-4-yl]hydrazine.
What is the SMILES notation for [6-ethyl-2-(5-fluoro-2-pyridinyl)-5-methylpyrimidin-4-yl]hydrazine?
The canonical SMILES for [6-ethyl-2-(5-fluoro-2-pyridinyl)-5-methylpyrimidin-4-yl]hydrazine is CCc1nc(-c2ccc(F)cn2)nc(NN)c1C.
What is the InChIKey of [6-ethyl-2-(5-fluoro-2-pyridinyl)-5-methylpyrimidin-4-yl]hydrazine?
The InChIKey is BPPSYZRIAYGCPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14FN5/c1-3-9-7(2)11(18-14)17-12(16-9)10-5-4-8(13)6-15-10/h4-6H,3,14H2,1-2H3,(H,16,17,18).
What are the key properties of [6-ethyl-2-(5-fluoro-2-pyridinyl)-5-methylpyrimidin-4-yl]hydrazine?
[6-ethyl-2-(5-fluoro-2-pyridinyl)-5-methylpyrimidin-4-yl]hydrazine has a molecular weight of 247.28 g/mol, XLogP of 1.83, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-ethyl-2-(5-fluoro-2-pyridinyl)-5-methylpyrimidin-4-yl]hydrazine is sourced from PubChem (CID 79718877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).