[(3-bromo-2-methylphenyl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine

C15H21BrN4O — CID 105339867

IUPAC[(3-bromo-2-methylphenyl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine
SMILESCCCn1ncc(OC)c1C(NN)c1cccc(Br)c1C
InChIInChI=1S/C15H21BrN4O/c1-4-8-20-15(13(21-3)9-18-20)14(19-17)11-6-5-7-12(16)10(11)2/h5-7,9,14,19H,4,8,17H2,1-3H3
InChIKeyJVXUCXABDNWZPI-UHFFFAOYSA-N
MW353.26 g/mol
LogP2.93
Rot. Bonds6

About [(3-bromo-2-methylphenyl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine

[(3-bromo-2-methylphenyl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine (PubChem CID 105339867) has the molecular formula C15H21BrN4O and a molecular weight of 353.26 g/mol. Its IUPAC name is [(3-bromo-2-methylphenyl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-bromo-2-methylphenyl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine
PubChem CID105339867
Molecular FormulaC15H21BrN4O
Molecular Weight353.26 g/mol
Exact Mass352.09
IUPAC Name[(3-bromo-2-methylphenyl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine
SMILESCCCn1ncc(OC)c1C(NN)c1cccc(Br)c1C
InChIInChI=1S/C15H21BrN4O/c1-4-8-20-15(13(21-3)9-18-20)14(19-17)11-6-5-7-12(16)10(11)2/h5-7,9,14,19H,4,8,17H2,1-3H3
InChIKeyJVXUCXABDNWZPI-UHFFFAOYSA-N
XLogP2.93
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.26
LogP ≤ 52.93
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

[(3-bromo-2-chlorophenyl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine
CID 105339857
[(2-bromo-6-fluorophenyl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine
CID 105280420
[[4-bromo-1-(2-methoxyethyl)pyrazol-5-yl]-(3-bromo-2-methylphenyl)methyl]hydrazine
CID 105337364
[(4-methoxy-1-propylpyrazol-5-yl)-(6-methyl-2-pyridinyl)methyl]hydrazine
CID 105219117
[(4-methoxy-1-propylpyrazol-5-yl)-(4-methyl-3-pyridinyl)methyl]hydrazine
CID 105279840
4-bromo-2-[hydrazinyl-(4-methoxy-1-propylpyrazol-5-yl)methyl]aniline
CID 105263508
[(2,5-dibromothiophen-3-yl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine
CID 107970637
1-(4-methoxy-1-propylpyrazol-5-yl)ethylhydrazine
CID 105201289
[(4-methoxy-1-propylpyrazol-5-yl)-(2H-triazol-4-yl)methyl]hydrazine
CID 105254778
[(4-methoxy-1-propylpyrazol-5-yl)-pyridazin-4-ylmethyl]hydrazine
CID 105339836
[(4-methoxy-1-propylpyrazol-5-yl)-(2-methylpyrimidin-4-yl)methyl]hydrazine
CID 105260511
1-(3-bromo-2-pyridinyl)-1-(4-methoxy-1-propylpyrazol-5-yl)-N-methylmethanamine
CID 114660556

Frequently Asked Questions

What is the IUPAC name of [(3-bromo-2-methylphenyl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine?
The IUPAC name of [(3-bromo-2-methylphenyl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine (CID 105339867) is [(3-bromo-2-methylphenyl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine.
What is the SMILES notation for [(3-bromo-2-methylphenyl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine?
The canonical SMILES for [(3-bromo-2-methylphenyl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine is CCCn1ncc(OC)c1C(NN)c1cccc(Br)c1C.
What is the InChIKey of [(3-bromo-2-methylphenyl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine?
The InChIKey is JVXUCXABDNWZPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21BrN4O/c1-4-8-20-15(13(21-3)9-18-20)14(19-17)11-6-5-7-12(16)10(11)2/h5-7,9,14,19H,4,8,17H2,1-3H3.
What are the key properties of [(3-bromo-2-methylphenyl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine?
[(3-bromo-2-methylphenyl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine has a molecular weight of 353.26 g/mol, XLogP of 2.93, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-bromo-2-methylphenyl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine is sourced from PubChem (CID 105339867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).