[(1-ethylpyrazol-4-yl)-(1-phenylcyclobutyl)methyl]hydrazine

C16H22N4 — CID 105217294

IUPAC[(1-ethylpyrazol-4-yl)-(1-phenylcyclobutyl)methyl]hydrazine
SMILESCCn1cc(C(NN)C2(c3ccccc3)CCC2)cn1
InChIInChI=1S/C16H22N4/c1-2-20-12-13(11-18-20)15(19-17)16(9-6-10-16)14-7-4-3-5-8-14/h3-5,7-8,11-12,15,19H,2,6,9-10,17H2,1H3
InChIKeyXZFUPZSWCNLVIM-UHFFFAOYSA-N
MW270.38 g/mol
LogP2.53
Rot. Bonds5

About [(1-ethylpyrazol-4-yl)-(1-phenylcyclobutyl)methyl]hydrazine

[(1-ethylpyrazol-4-yl)-(1-phenylcyclobutyl)methyl]hydrazine (PubChem CID 105217294) has the molecular formula C16H22N4 and a molecular weight of 270.38 g/mol. Its IUPAC name is [(1-ethylpyrazol-4-yl)-(1-phenylcyclobutyl)methyl]hydrazine.

Molecular Properties

Compound Name[(1-ethylpyrazol-4-yl)-(1-phenylcyclobutyl)methyl]hydrazine
PubChem CID105217294
Molecular FormulaC16H22N4
Molecular Weight270.38 g/mol
Exact Mass270.18
IUPAC Name[(1-ethylpyrazol-4-yl)-(1-phenylcyclobutyl)methyl]hydrazine
SMILESCCn1cc(C(NN)C2(c3ccccc3)CCC2)cn1
InChIInChI=1S/C16H22N4/c1-2-20-12-13(11-18-20)15(19-17)16(9-6-10-16)14-7-4-3-5-8-14/h3-5,7-8,11-12,15,19H,2,6,9-10,17H2,1H3
InChIKeyXZFUPZSWCNLVIM-UHFFFAOYSA-N
XLogP2.53
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 52.53
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 [(1-ethylpyrazol-4-yl)-(1-phenylcyclobutyl)methyl]hydrazine?
The IUPAC name of [(1-ethylpyrazol-4-yl)-(1-phenylcyclobutyl)methyl]hydrazine (CID 105217294) is [(1-ethylpyrazol-4-yl)-(1-phenylcyclobutyl)methyl]hydrazine.
What is the SMILES notation for [(1-ethylpyrazol-4-yl)-(1-phenylcyclobutyl)methyl]hydrazine?
The canonical SMILES for [(1-ethylpyrazol-4-yl)-(1-phenylcyclobutyl)methyl]hydrazine is CCn1cc(C(NN)C2(c3ccccc3)CCC2)cn1.
What is the InChIKey of [(1-ethylpyrazol-4-yl)-(1-phenylcyclobutyl)methyl]hydrazine?
The InChIKey is XZFUPZSWCNLVIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4/c1-2-20-12-13(11-18-20)15(19-17)16(9-6-10-16)14-7-4-3-5-8-14/h3-5,7-8,11-12,15,19H,2,6,9-10,17H2,1H3.
What are the key properties of [(1-ethylpyrazol-4-yl)-(1-phenylcyclobutyl)methyl]hydrazine?
[(1-ethylpyrazol-4-yl)-(1-phenylcyclobutyl)methyl]hydrazine has a molecular weight of 270.38 g/mol, XLogP of 2.53, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(1-ethylpyrazol-4-yl)-(1-phenylcyclobutyl)methyl]hydrazine is sourced from PubChem (CID 105217294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).