[6-cyclopropyl-2-(4-fluoro-3-methylphenyl)pyrimidin-4-yl]hydrazine

C14H15FN4 — CID 63354408

IUPAC[6-cyclopropyl-2-(4-fluoro-3-methylphenyl)pyrimidin-4-yl]hydrazine
SMILESCc1cc(-c2nc(NN)cc(C3CC3)n2)ccc1F
InChIInChI=1S/C14H15FN4/c1-8-6-10(4-5-11(8)15)14-17-12(9-2-3-9)7-13(18-14)19-16/h4-7,9H,2-3,16H2,1H3,(H,17,18,19)
InChIKeyWLUFDFQWOYNWKJ-UHFFFAOYSA-N
MW258.30 g/mol
LogP2.75
Rot. Bonds3

About [6-cyclopropyl-2-(4-fluoro-3-methylphenyl)pyrimidin-4-yl]hydrazine

[6-cyclopropyl-2-(4-fluoro-3-methylphenyl)pyrimidin-4-yl]hydrazine (PubChem CID 63354408) has the molecular formula C14H15FN4 and a molecular weight of 258.30 g/mol. Its IUPAC name is [6-cyclopropyl-2-(4-fluoro-3-methylphenyl)pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[6-cyclopropyl-2-(4-fluoro-3-methylphenyl)pyrimidin-4-yl]hydrazine
PubChem CID63354408
Molecular FormulaC14H15FN4
Molecular Weight258.30 g/mol
Exact Mass258.13
IUPAC Name[6-cyclopropyl-2-(4-fluoro-3-methylphenyl)pyrimidin-4-yl]hydrazine
SMILESCc1cc(-c2nc(NN)cc(C3CC3)n2)ccc1F
InChIInChI=1S/C14H15FN4/c1-8-6-10(4-5-11(8)15)14-17-12(9-2-3-9)7-13(18-14)19-16/h4-7,9H,2-3,16H2,1H3,(H,17,18,19)
InChIKeyWLUFDFQWOYNWKJ-UHFFFAOYSA-N
XLogP2.75
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.30
LogP ≤ 52.75
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 [6-cyclopropyl-2-(4-fluoro-3-methylphenyl)pyrimidin-4-yl]hydrazine?
The IUPAC name of [6-cyclopropyl-2-(4-fluoro-3-methylphenyl)pyrimidin-4-yl]hydrazine (CID 63354408) is [6-cyclopropyl-2-(4-fluoro-3-methylphenyl)pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [6-cyclopropyl-2-(4-fluoro-3-methylphenyl)pyrimidin-4-yl]hydrazine?
The canonical SMILES for [6-cyclopropyl-2-(4-fluoro-3-methylphenyl)pyrimidin-4-yl]hydrazine is Cc1cc(-c2nc(NN)cc(C3CC3)n2)ccc1F.
What is the InChIKey of [6-cyclopropyl-2-(4-fluoro-3-methylphenyl)pyrimidin-4-yl]hydrazine?
The InChIKey is WLUFDFQWOYNWKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN4/c1-8-6-10(4-5-11(8)15)14-17-12(9-2-3-9)7-13(18-14)19-16/h4-7,9H,2-3,16H2,1H3,(H,17,18,19).
What are the key properties of [6-cyclopropyl-2-(4-fluoro-3-methylphenyl)pyrimidin-4-yl]hydrazine?
[6-cyclopropyl-2-(4-fluoro-3-methylphenyl)pyrimidin-4-yl]hydrazine has a molecular weight of 258.30 g/mol, XLogP of 2.75, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-cyclopropyl-2-(4-fluoro-3-methylphenyl)pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 63354408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).