[(3,5-dimethylphenyl)-(1-methylpyrazol-4-yl)methyl]hydrazine

C13H18N4 — CID 105228493

IUPAC[(3,5-dimethylphenyl)-(1-methylpyrazol-4-yl)methyl]hydrazine
SMILESCc1cc(C)cc(C(NN)c2cnn(C)c2)c1
InChIInChI=1S/C13H18N4/c1-9-4-10(2)6-11(5-9)13(16-14)12-7-15-17(3)8-12/h4-8,13,16H,14H2,1-3H3
InChIKeyORZRLNUSRIFCAV-UHFFFAOYSA-N
MW230.31 g/mol
LogP1.59
Rot. Bonds3

About [(3,5-dimethylphenyl)-(1-methylpyrazol-4-yl)methyl]hydrazine

[(3,5-dimethylphenyl)-(1-methylpyrazol-4-yl)methyl]hydrazine (PubChem CID 105228493) has the molecular formula C13H18N4 and a molecular weight of 230.31 g/mol. Its IUPAC name is [(3,5-dimethylphenyl)-(1-methylpyrazol-4-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(3,5-dimethylphenyl)-(1-methylpyrazol-4-yl)methyl]hydrazine
PubChem CID105228493
Molecular FormulaC13H18N4
Molecular Weight230.31 g/mol
Exact Mass230.15
IUPAC Name[(3,5-dimethylphenyl)-(1-methylpyrazol-4-yl)methyl]hydrazine
SMILESCc1cc(C)cc(C(NN)c2cnn(C)c2)c1
InChIInChI=1S/C13H18N4/c1-9-4-10(2)6-11(5-9)13(16-14)12-7-15-17(3)8-12/h4-8,13,16H,14H2,1-3H3
InChIKeyORZRLNUSRIFCAV-UHFFFAOYSA-N
XLogP1.59
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 51.59
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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Related Compounds

[(1-methylpyrazol-4-yl)-(2,4,6-trimethylphenyl)methyl]hydrazine
CID 105288719
[(3-bromo-5-methylphenyl)-(1-propylpyrazol-4-yl)methyl]hydrazine
CID 105288475
[(4-methoxy-3-methylphenyl)-(1-methylpyrazol-4-yl)methyl]hydrazine
CID 105258318
[(1-methylpyrazol-3-yl)-(1-methylpyrazol-4-yl)methyl]hydrazine
CID 105228610
[(6-methoxypyrimidin-4-yl)-(1-methylpyrazol-4-yl)methyl]hydrazine
CID 102953404
3-[hydrazinyl-(1-methylpyrazol-4-yl)methyl]-N,N-dimethylaniline
CID 105288676
[(4-fluoro-2-methylphenyl)-(1-methylpyrazol-4-yl)methyl]hydrazine
CID 105228355
[(1-methylpyrazol-4-yl)-(2-methylpyrimidin-4-yl)methyl]hydrazine
CID 105260408
[(1-methylpyrazol-4-yl)-(3-propylphenyl)methyl]hydrazine
CID 105228480
[(5-chloro-2-pyridinyl)-(1-methylpyrazol-4-yl)methyl]hydrazine
CID 105251383
[(1-methylpyrazol-4-yl)-(1H-1,2,4-triazol-5-yl)methyl]hydrazine
CID 105230377
[(2-bromo-5-fluorophenyl)-(1-methylpyrazol-4-yl)methyl]hydrazine
CID 105288776

Frequently Asked Questions

What is the IUPAC name of [(3,5-dimethylphenyl)-(1-methylpyrazol-4-yl)methyl]hydrazine?
The IUPAC name of [(3,5-dimethylphenyl)-(1-methylpyrazol-4-yl)methyl]hydrazine (CID 105228493) is [(3,5-dimethylphenyl)-(1-methylpyrazol-4-yl)methyl]hydrazine.
What is the SMILES notation for [(3,5-dimethylphenyl)-(1-methylpyrazol-4-yl)methyl]hydrazine?
The canonical SMILES for [(3,5-dimethylphenyl)-(1-methylpyrazol-4-yl)methyl]hydrazine is Cc1cc(C)cc(C(NN)c2cnn(C)c2)c1.
What is the InChIKey of [(3,5-dimethylphenyl)-(1-methylpyrazol-4-yl)methyl]hydrazine?
The InChIKey is ORZRLNUSRIFCAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4/c1-9-4-10(2)6-11(5-9)13(16-14)12-7-15-17(3)8-12/h4-8,13,16H,14H2,1-3H3.
What are the key properties of [(3,5-dimethylphenyl)-(1-methylpyrazol-4-yl)methyl]hydrazine?
[(3,5-dimethylphenyl)-(1-methylpyrazol-4-yl)methyl]hydrazine has a molecular weight of 230.31 g/mol, XLogP of 1.59, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(3,5-dimethylphenyl)-(1-methylpyrazol-4-yl)methyl]hydrazine is sourced from PubChem (CID 105228493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).