[5-fluoro-4-(1,1,1-trifluoropropan-2-yloxy)pyrimidin-2-yl]hydrazine

C7H8F4N4O — CID 80922585

IUPAC[5-fluoro-4-(1,1,1-trifluoropropan-2-yloxy)pyrimidin-2-yl]hydrazine
SMILESCC(Oc1nc(NN)ncc1F)C(F)(F)F
InChIInChI=1S/C7H8F4N4O/c1-3(7(9,10)11)16-5-4(8)2-13-6(14-5)15-12/h2-3H,12H2,1H3,(H,13,14,15)
InChIKeyQWVGPOJSQGQIOR-UHFFFAOYSA-N
MW240.16 g/mol
LogP1.23
Rot. Bonds3

About [5-fluoro-4-(1,1,1-trifluoropropan-2-yloxy)pyrimidin-2-yl]hydrazine

[5-fluoro-4-(1,1,1-trifluoropropan-2-yloxy)pyrimidin-2-yl]hydrazine (PubChem CID 80922585) has the molecular formula C7H8F4N4O and a molecular weight of 240.16 g/mol. Its IUPAC name is [5-fluoro-4-(1,1,1-trifluoropropan-2-yloxy)pyrimidin-2-yl]hydrazine.

Molecular Properties

Compound Name[5-fluoro-4-(1,1,1-trifluoropropan-2-yloxy)pyrimidin-2-yl]hydrazine
PubChem CID80922585
Molecular FormulaC7H8F4N4O
Molecular Weight240.16 g/mol
Exact Mass240.06
IUPAC Name[5-fluoro-4-(1,1,1-trifluoropropan-2-yloxy)pyrimidin-2-yl]hydrazine
SMILESCC(Oc1nc(NN)ncc1F)C(F)(F)F
InChIInChI=1S/C7H8F4N4O/c1-3(7(9,10)11)16-5-4(8)2-13-6(14-5)15-12/h2-3H,12H2,1H3,(H,13,14,15)
InChIKeyQWVGPOJSQGQIOR-UHFFFAOYSA-N
XLogP1.23
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.16
LogP ≤ 51.23
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'}

Analyze [5-fluoro-4-(1,1,1-trifluoropropan-2-yloxy)pyrimidin-2-yl]hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[4-(1,1,1-trifluoropropan-2-yloxy)thieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103336356
(5-fluoro-4-propoxypyrimidin-2-yl)hydrazine
CID 80911557
[5-fluoro-4-(2-methylbutan-2-yloxy)pyrimidin-2-yl]hydrazine
CID 80909725
4-butan-2-yloxy-5-fluoro-N-methylpyrimidin-2-amine
CID 80866074
[5-fluoro-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyrimidin-2-yl]hydrazine
CID 104568409
[4-(4-bromo-2-propan-2-ylphenoxy)-5-fluoropyrimidin-2-yl]hydrazine
CID 115403150
[4-methyl-5-nitro-6-(1,1,1-trifluoropropan-2-yloxy)pyrimidin-2-yl]hydrazine
CID 114045195
(5-chloro-4-propan-2-yloxypyrimidin-2-yl)hydrazine
CID 80913433
[5-fluoro-4-(2,3,5-trimethylphenoxy)pyrimidin-2-yl]hydrazine
CID 80916575
[5-fluoro-4-[4-(2-methylbutan-2-yl)phenoxy]pyrimidin-2-yl]hydrazine
CID 80910662
5-chloro-4-(1,1,1-trifluoropropan-2-yloxy)pyrimidin-2-amine
CID 80877300
[4-propoxy-6-(1,1,1-trifluoropropan-2-yloxy)-1,3,5-triazin-2-yl]hydrazine
CID 80923867

Frequently Asked Questions

What is the IUPAC name of [5-fluoro-4-(1,1,1-trifluoropropan-2-yloxy)pyrimidin-2-yl]hydrazine?
The IUPAC name of [5-fluoro-4-(1,1,1-trifluoropropan-2-yloxy)pyrimidin-2-yl]hydrazine (CID 80922585) is [5-fluoro-4-(1,1,1-trifluoropropan-2-yloxy)pyrimidin-2-yl]hydrazine.
What is the SMILES notation for [5-fluoro-4-(1,1,1-trifluoropropan-2-yloxy)pyrimidin-2-yl]hydrazine?
The canonical SMILES for [5-fluoro-4-(1,1,1-trifluoropropan-2-yloxy)pyrimidin-2-yl]hydrazine is CC(Oc1nc(NN)ncc1F)C(F)(F)F.
What is the InChIKey of [5-fluoro-4-(1,1,1-trifluoropropan-2-yloxy)pyrimidin-2-yl]hydrazine?
The InChIKey is QWVGPOJSQGQIOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F4N4O/c1-3(7(9,10)11)16-5-4(8)2-13-6(14-5)15-12/h2-3H,12H2,1H3,(H,13,14,15).
What are the key properties of [5-fluoro-4-(1,1,1-trifluoropropan-2-yloxy)pyrimidin-2-yl]hydrazine?
[5-fluoro-4-(1,1,1-trifluoropropan-2-yloxy)pyrimidin-2-yl]hydrazine has a molecular weight of 240.16 g/mol, XLogP of 1.23, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-fluoro-4-(1,1,1-trifluoropropan-2-yloxy)pyrimidin-2-yl]hydrazine is sourced from PubChem (CID 80922585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).