[5-fluoro-6-methyl-2-[5-(2-methylcyclopropyl)furan-2-yl]pyrimidin-4-yl]hydrazine

C13H15FN4O — CID 66000046

IUPAC[5-fluoro-6-methyl-2-[5-(2-methylcyclopropyl)furan-2-yl]pyrimidin-4-yl]hydrazine
SMILESCc1nc(-c2ccc(C3CC3C)o2)nc(NN)c1F
InChIInChI=1S/C13H15FN4O/c1-6-5-8(6)9-3-4-10(19-9)12-16-7(2)11(14)13(17-12)18-15/h3-4,6,8H,5,15H2,1-2H3,(H,16,17,18)
InChIKeyVQVUVBMIPJTVCC-UHFFFAOYSA-N
MW262.29 g/mol
LogP2.59
Rot. Bonds3

About [5-fluoro-6-methyl-2-[5-(2-methylcyclopropyl)furan-2-yl]pyrimidin-4-yl]hydrazine

[5-fluoro-6-methyl-2-[5-(2-methylcyclopropyl)furan-2-yl]pyrimidin-4-yl]hydrazine (PubChem CID 66000046) has the molecular formula C13H15FN4O and a molecular weight of 262.29 g/mol. Its IUPAC name is [5-fluoro-6-methyl-2-[5-(2-methylcyclopropyl)furan-2-yl]pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[5-fluoro-6-methyl-2-[5-(2-methylcyclopropyl)furan-2-yl]pyrimidin-4-yl]hydrazine
PubChem CID66000046
Molecular FormulaC13H15FN4O
Molecular Weight262.29 g/mol
Exact Mass262.12
IUPAC Name[5-fluoro-6-methyl-2-[5-(2-methylcyclopropyl)furan-2-yl]pyrimidin-4-yl]hydrazine
SMILESCc1nc(-c2ccc(C3CC3C)o2)nc(NN)c1F
InChIInChI=1S/C13H15FN4O/c1-6-5-8(6)9-3-4-10(19-9)12-16-7(2)11(14)13(17-12)18-15/h3-4,6,8H,5,15H2,1-2H3,(H,16,17,18)
InChIKeyVQVUVBMIPJTVCC-UHFFFAOYSA-N
XLogP2.59
TPSA76.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.29
LogP ≤ 52.59
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 [5-fluoro-6-methyl-2-[5-(2-methylcyclopropyl)furan-2-yl]pyrimidin-4-yl]hydrazine?
The IUPAC name of [5-fluoro-6-methyl-2-[5-(2-methylcyclopropyl)furan-2-yl]pyrimidin-4-yl]hydrazine (CID 66000046) is [5-fluoro-6-methyl-2-[5-(2-methylcyclopropyl)furan-2-yl]pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [5-fluoro-6-methyl-2-[5-(2-methylcyclopropyl)furan-2-yl]pyrimidin-4-yl]hydrazine?
The canonical SMILES for [5-fluoro-6-methyl-2-[5-(2-methylcyclopropyl)furan-2-yl]pyrimidin-4-yl]hydrazine is Cc1nc(-c2ccc(C3CC3C)o2)nc(NN)c1F.
What is the InChIKey of [5-fluoro-6-methyl-2-[5-(2-methylcyclopropyl)furan-2-yl]pyrimidin-4-yl]hydrazine?
The InChIKey is VQVUVBMIPJTVCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15FN4O/c1-6-5-8(6)9-3-4-10(19-9)12-16-7(2)11(14)13(17-12)18-15/h3-4,6,8H,5,15H2,1-2H3,(H,16,17,18).
What are the key properties of [5-fluoro-6-methyl-2-[5-(2-methylcyclopropyl)furan-2-yl]pyrimidin-4-yl]hydrazine?
[5-fluoro-6-methyl-2-[5-(2-methylcyclopropyl)furan-2-yl]pyrimidin-4-yl]hydrazine has a molecular weight of 262.29 g/mol, XLogP of 2.59, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-fluoro-6-methyl-2-[5-(2-methylcyclopropyl)furan-2-yl]pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 66000046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).