[5-fluoro-4-(3-propan-2-ylpyrazol-1-yl)pyrimidin-2-yl]hydrazine

C10H13FN6 — CID 80902367

IUPAC[5-fluoro-4-(3-propan-2-ylpyrazol-1-yl)pyrimidin-2-yl]hydrazine
SMILESCC(C)c1ccn(-c2nc(NN)ncc2F)n1
InChIInChI=1S/C10H13FN6/c1-6(2)8-3-4-17(16-8)9-7(11)5-13-10(14-9)15-12/h3-6H,12H2,1-2H3,(H,13,14,15)
InChIKeyXURFPFZBMUVUOF-UHFFFAOYSA-N
MW236.25 g/mol
LogP1.21
Rot. Bonds3

About [5-fluoro-4-(3-propan-2-ylpyrazol-1-yl)pyrimidin-2-yl]hydrazine

[5-fluoro-4-(3-propan-2-ylpyrazol-1-yl)pyrimidin-2-yl]hydrazine (PubChem CID 80902367) has the molecular formula C10H13FN6 and a molecular weight of 236.25 g/mol. Its IUPAC name is [5-fluoro-4-(3-propan-2-ylpyrazol-1-yl)pyrimidin-2-yl]hydrazine.

Molecular Properties

Compound Name[5-fluoro-4-(3-propan-2-ylpyrazol-1-yl)pyrimidin-2-yl]hydrazine
PubChem CID80902367
Molecular FormulaC10H13FN6
Molecular Weight236.25 g/mol
Exact Mass236.12
IUPAC Name[5-fluoro-4-(3-propan-2-ylpyrazol-1-yl)pyrimidin-2-yl]hydrazine
SMILESCC(C)c1ccn(-c2nc(NN)ncc2F)n1
InChIInChI=1S/C10H13FN6/c1-6(2)8-3-4-17(16-8)9-7(11)5-13-10(14-9)15-12/h3-6H,12H2,1-2H3,(H,13,14,15)
InChIKeyXURFPFZBMUVUOF-UHFFFAOYSA-N
XLogP1.21
TPSA81.65 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.25
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[5-fluoro-4-[3-(trifluoromethyl)pyrazol-1-yl]pyrimidin-2-yl]hydrazine
CID 80899957
[4-(3-propan-2-ylpyrazol-1-yl)quinazolin-2-yl]hydrazine
CID 80901736
[5-propan-2-yl-6-(3-propan-2-ylpyrazol-1-yl)pyrimidin-4-yl]hydrazine
CID 80900555
[4-(3,5-dimethylpyrazol-1-yl)-5-fluoropyrimidin-2-yl]hydrazine
CID 80901964
[5-fluoro-4-(4-methylpiperazin-1-yl)pyrimidin-2-yl]hydrazine
CID 80927536
4-(3-cyclopropylpyrazol-1-yl)-5-fluoro-N-methylpyrimidin-2-amine
CID 80857928
N,6-dimethyl-4-(3-propan-2-ylpyrazol-1-yl)thieno[2,3-d]pyrimidin-2-amine
CID 103331095
1-(5-fluoro-2-hydrazinylpyrimidin-4-yl)pyrazole-4-carboxamide
CID 80902996
[5-fluoro-2-(3-propan-2-ylpyrazol-1-yl)-3-pyridinyl]methanol
CID 114034674
1-(5-fluoro-2-hydrazinylpyrimidin-4-yl)pyrrolidine-3,4-diol
CID 106674672
5-fluoro-N-propyl-4-[3-(trifluoromethyl)pyrazol-1-yl]pyrimidin-2-amine
CID 80857272
[4-(5,6-dimethylbenzimidazol-1-yl)-5-fluoropyrimidin-2-yl]hydrazine
CID 80900657

Frequently Asked Questions

What is the IUPAC name of [5-fluoro-4-(3-propan-2-ylpyrazol-1-yl)pyrimidin-2-yl]hydrazine?
The IUPAC name of [5-fluoro-4-(3-propan-2-ylpyrazol-1-yl)pyrimidin-2-yl]hydrazine (CID 80902367) is [5-fluoro-4-(3-propan-2-ylpyrazol-1-yl)pyrimidin-2-yl]hydrazine.
What is the SMILES notation for [5-fluoro-4-(3-propan-2-ylpyrazol-1-yl)pyrimidin-2-yl]hydrazine?
The canonical SMILES for [5-fluoro-4-(3-propan-2-ylpyrazol-1-yl)pyrimidin-2-yl]hydrazine is CC(C)c1ccn(-c2nc(NN)ncc2F)n1.
What is the InChIKey of [5-fluoro-4-(3-propan-2-ylpyrazol-1-yl)pyrimidin-2-yl]hydrazine?
The InChIKey is XURFPFZBMUVUOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FN6/c1-6(2)8-3-4-17(16-8)9-7(11)5-13-10(14-9)15-12/h3-6H,12H2,1-2H3,(H,13,14,15).
What are the key properties of [5-fluoro-4-(3-propan-2-ylpyrazol-1-yl)pyrimidin-2-yl]hydrazine?
[5-fluoro-4-(3-propan-2-ylpyrazol-1-yl)pyrimidin-2-yl]hydrazine has a molecular weight of 236.25 g/mol, XLogP of 1.21, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [5-fluoro-4-(3-propan-2-ylpyrazol-1-yl)pyrimidin-2-yl]hydrazine is sourced from PubChem (CID 80902367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).