[1-(1,3-dimethylpyrazol-4-yl)-3-(4-methoxyphenyl)propyl]hydrazine

C15H22N4O — CID 102804965

IUPAC[1-(1,3-dimethylpyrazol-4-yl)-3-(4-methoxyphenyl)propyl]hydrazine
SMILESCOc1ccc(CCC(NN)c2cn(C)nc2C)cc1
InChIInChI=1S/C15H22N4O/c1-11-14(10-19(2)18-11)15(17-16)9-6-12-4-7-13(20-3)8-5-12/h4-5,7-8,10,15,17H,6,9,16H2,1-3H3
InChIKeyXVMXGIWUKZBLRS-UHFFFAOYSA-N
MW274.37 g/mol
LogP1.87
Rot. Bonds6

About [1-(1,3-dimethylpyrazol-4-yl)-3-(4-methoxyphenyl)propyl]hydrazine

[1-(1,3-dimethylpyrazol-4-yl)-3-(4-methoxyphenyl)propyl]hydrazine (PubChem CID 102804965) has the molecular formula C15H22N4O and a molecular weight of 274.37 g/mol. Its IUPAC name is [1-(1,3-dimethylpyrazol-4-yl)-3-(4-methoxyphenyl)propyl]hydrazine.

Molecular Properties

Compound Name[1-(1,3-dimethylpyrazol-4-yl)-3-(4-methoxyphenyl)propyl]hydrazine
PubChem CID102804965
Molecular FormulaC15H22N4O
Molecular Weight274.37 g/mol
Exact Mass274.18
IUPAC Name[1-(1,3-dimethylpyrazol-4-yl)-3-(4-methoxyphenyl)propyl]hydrazine
SMILESCOc1ccc(CCC(NN)c2cn(C)nc2C)cc1
InChIInChI=1S/C15H22N4O/c1-11-14(10-19(2)18-11)15(17-16)9-6-12-4-7-13(20-3)8-5-12/h4-5,7-8,10,15,17H,6,9,16H2,1-3H3
InChIKeyXVMXGIWUKZBLRS-UHFFFAOYSA-N
XLogP1.87
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.37
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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-(1,3-dimethylpyrazol-4-yl)-N-ethyl-3-(4-methoxyphenyl)propan-1-amine
CID 102803821
[1-(1,3-dimethylpyrazol-4-yl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine
CID 103026121
[1-(2-iodophenyl)-3-(4-methoxyphenyl)propyl]hydrazine
CID 105310577
[1-(2-fluoro-5-methylphenyl)-3-(4-methoxyphenyl)propyl]hydrazine
CID 105302706
[1-(4-bromo-2-methylphenyl)-3-(4-methoxyphenyl)propyl]hydrazine
CID 105310534
1-(1,3-dimethylpyrazol-4-yl)decylhydrazine
CID 102804828
[1-(3-fluoro-4-pyridinyl)-3-(4-methoxyphenyl)propyl]hydrazine
CID 105258537
[1-(2,5-difluorophenyl)-3-(4-methoxyphenyl)propyl]hydrazine
CID 105219321
[1-(furan-2-yl)-3-(4-methoxyphenyl)propyl]hydrazine
CID 105213476
1-(1,3-dimethylpyrazol-4-yl)-3-(4-methoxyphenyl)propan-1-one
CID 102802775
[1-(4-fluoro-3-methylphenyl)-3-(4-methoxyphenyl)propyl]hydrazine
CID 105204009
3-[2-(4-methoxyphenyl)ethyl]-1,4-dimethylpyrazole
CID 155131154

Frequently Asked Questions

What is the IUPAC name of [1-(1,3-dimethylpyrazol-4-yl)-3-(4-methoxyphenyl)propyl]hydrazine?
The IUPAC name of [1-(1,3-dimethylpyrazol-4-yl)-3-(4-methoxyphenyl)propyl]hydrazine (CID 102804965) is [1-(1,3-dimethylpyrazol-4-yl)-3-(4-methoxyphenyl)propyl]hydrazine.
What is the SMILES notation for [1-(1,3-dimethylpyrazol-4-yl)-3-(4-methoxyphenyl)propyl]hydrazine?
The canonical SMILES for [1-(1,3-dimethylpyrazol-4-yl)-3-(4-methoxyphenyl)propyl]hydrazine is COc1ccc(CCC(NN)c2cn(C)nc2C)cc1.
What is the InChIKey of [1-(1,3-dimethylpyrazol-4-yl)-3-(4-methoxyphenyl)propyl]hydrazine?
The InChIKey is XVMXGIWUKZBLRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O/c1-11-14(10-19(2)18-11)15(17-16)9-6-12-4-7-13(20-3)8-5-12/h4-5,7-8,10,15,17H,6,9,16H2,1-3H3.
What are the key properties of [1-(1,3-dimethylpyrazol-4-yl)-3-(4-methoxyphenyl)propyl]hydrazine?
[1-(1,3-dimethylpyrazol-4-yl)-3-(4-methoxyphenyl)propyl]hydrazine has a molecular weight of 274.37 g/mol, XLogP of 1.87, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1,3-dimethylpyrazol-4-yl)-3-(4-methoxyphenyl)propyl]hydrazine is sourced from PubChem (CID 102804965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).