[(1-methylpyrazol-4-yl)-(3-propylphenyl)methyl]hydrazine

C14H20N4 — CID 105228480

IUPAC[(1-methylpyrazol-4-yl)-(3-propylphenyl)methyl]hydrazine
SMILESCCCc1cccc(C(NN)c2cnn(C)c2)c1
InChIInChI=1S/C14H20N4/c1-3-5-11-6-4-7-12(8-11)14(17-15)13-9-16-18(2)10-13/h4,6-10,14,17H,3,5,15H2,1-2H3
InChIKeyJWOKQTNTTGPCLY-UHFFFAOYSA-N
MW244.34 g/mol
LogP1.93
Rot. Bonds5

About [(1-methylpyrazol-4-yl)-(3-propylphenyl)methyl]hydrazine

[(1-methylpyrazol-4-yl)-(3-propylphenyl)methyl]hydrazine (PubChem CID 105228480) has the molecular formula C14H20N4 and a molecular weight of 244.34 g/mol. Its IUPAC name is [(1-methylpyrazol-4-yl)-(3-propylphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(1-methylpyrazol-4-yl)-(3-propylphenyl)methyl]hydrazine
PubChem CID105228480
Molecular FormulaC14H20N4
Molecular Weight244.34 g/mol
Exact Mass244.17
IUPAC Name[(1-methylpyrazol-4-yl)-(3-propylphenyl)methyl]hydrazine
SMILESCCCc1cccc(C(NN)c2cnn(C)c2)c1
InChIInChI=1S/C14H20N4/c1-3-5-11-6-4-7-12(8-11)14(17-15)13-9-16-18(2)10-13/h4,6-10,14,17H,3,5,15H2,1-2H3
InChIKeyJWOKQTNTTGPCLY-UHFFFAOYSA-N
XLogP1.93
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 51.93
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-methylpyrazol-4-yl)-(3-propylphenyl)methyl]hydrazine?
The IUPAC name of [(1-methylpyrazol-4-yl)-(3-propylphenyl)methyl]hydrazine (CID 105228480) is [(1-methylpyrazol-4-yl)-(3-propylphenyl)methyl]hydrazine.
What is the SMILES notation for [(1-methylpyrazol-4-yl)-(3-propylphenyl)methyl]hydrazine?
The canonical SMILES for [(1-methylpyrazol-4-yl)-(3-propylphenyl)methyl]hydrazine is CCCc1cccc(C(NN)c2cnn(C)c2)c1.
What is the InChIKey of [(1-methylpyrazol-4-yl)-(3-propylphenyl)methyl]hydrazine?
The InChIKey is JWOKQTNTTGPCLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4/c1-3-5-11-6-4-7-12(8-11)14(17-15)13-9-16-18(2)10-13/h4,6-10,14,17H,3,5,15H2,1-2H3.
What are the key properties of [(1-methylpyrazol-4-yl)-(3-propylphenyl)methyl]hydrazine?
[(1-methylpyrazol-4-yl)-(3-propylphenyl)methyl]hydrazine has a molecular weight of 244.34 g/mol, XLogP of 1.93, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(1-methylpyrazol-4-yl)-(3-propylphenyl)methyl]hydrazine is sourced from PubChem (CID 105228480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).