(2-benzyl-6-cyclopropylpyrimidin-4-yl)hydrazine

C14H16N4 — CID 63354322

IUPAC(2-benzyl-6-cyclopropylpyrimidin-4-yl)hydrazine
SMILESNNc1cc(C2CC2)nc(Cc2ccccc2)n1
InChIInChI=1S/C14H16N4/c15-18-14-9-12(11-6-7-11)16-13(17-14)8-10-4-2-1-3-5-10/h1-5,9,11H,6-8,15H2,(H,16,17,18)
InChIKeyGYBXTGXMNWAGPL-UHFFFAOYSA-N
MW240.31 g/mol
LogP2.23
Rot. Bonds4

About (2-benzyl-6-cyclopropylpyrimidin-4-yl)hydrazine

(2-benzyl-6-cyclopropylpyrimidin-4-yl)hydrazine (PubChem CID 63354322) has the molecular formula C14H16N4 and a molecular weight of 240.31 g/mol. Its IUPAC name is (2-benzyl-6-cyclopropylpyrimidin-4-yl)hydrazine.

Molecular Properties

Compound Name(2-benzyl-6-cyclopropylpyrimidin-4-yl)hydrazine
PubChem CID63354322
Molecular FormulaC14H16N4
Molecular Weight240.31 g/mol
Exact Mass240.14
IUPAC Name(2-benzyl-6-cyclopropylpyrimidin-4-yl)hydrazine
SMILESNNc1cc(C2CC2)nc(Cc2ccccc2)n1
InChIInChI=1S/C14H16N4/c15-18-14-9-12(11-6-7-11)16-13(17-14)8-10-4-2-1-3-5-10/h1-5,9,11H,6-8,15H2,(H,16,17,18)
InChIKeyGYBXTGXMNWAGPL-UHFFFAOYSA-N
XLogP2.23
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 52.23
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 (2-benzyl-6-cyclopropylpyrimidin-4-yl)hydrazine?
The IUPAC name of (2-benzyl-6-cyclopropylpyrimidin-4-yl)hydrazine (CID 63354322) is (2-benzyl-6-cyclopropylpyrimidin-4-yl)hydrazine.
What is the SMILES notation for (2-benzyl-6-cyclopropylpyrimidin-4-yl)hydrazine?
The canonical SMILES for (2-benzyl-6-cyclopropylpyrimidin-4-yl)hydrazine is NNc1cc(C2CC2)nc(Cc2ccccc2)n1.
What is the InChIKey of (2-benzyl-6-cyclopropylpyrimidin-4-yl)hydrazine?
The InChIKey is GYBXTGXMNWAGPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4/c15-18-14-9-12(11-6-7-11)16-13(17-14)8-10-4-2-1-3-5-10/h1-5,9,11H,6-8,15H2,(H,16,17,18).
What are the key properties of (2-benzyl-6-cyclopropylpyrimidin-4-yl)hydrazine?
(2-benzyl-6-cyclopropylpyrimidin-4-yl)hydrazine has a molecular weight of 240.31 g/mol, XLogP of 2.23, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-benzyl-6-cyclopropylpyrimidin-4-yl)hydrazine is sourced from PubChem (CID 63354322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).