[(2-bromo-6-fluorophenyl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine

C14H18BrFN4O — CID 105280420

IUPAC[(2-bromo-6-fluorophenyl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine
SMILESCCCn1ncc(OC)c1C(NN)c1c(F)cccc1Br
InChIInChI=1S/C14H18BrFN4O/c1-3-7-20-14(11(21-2)8-18-20)13(19-17)12-9(15)5-4-6-10(12)16/h4-6,8,13,19H,3,7,17H2,1-2H3
InChIKeyOYFJINVPKDASFI-UHFFFAOYSA-N
MW357.23 g/mol
LogP2.76
Rot. Bonds6

About [(2-bromo-6-fluorophenyl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine

[(2-bromo-6-fluorophenyl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine (PubChem CID 105280420) has the molecular formula C14H18BrFN4O and a molecular weight of 357.23 g/mol. Its IUPAC name is [(2-bromo-6-fluorophenyl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(2-bromo-6-fluorophenyl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine
PubChem CID105280420
Molecular FormulaC14H18BrFN4O
Molecular Weight357.23 g/mol
Exact Mass356.06
IUPAC Name[(2-bromo-6-fluorophenyl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine
SMILESCCCn1ncc(OC)c1C(NN)c1c(F)cccc1Br
InChIInChI=1S/C14H18BrFN4O/c1-3-7-20-14(11(21-2)8-18-20)13(19-17)12-9(15)5-4-6-10(12)16/h4-6,8,13,19H,3,7,17H2,1-2H3
InChIKeyOYFJINVPKDASFI-UHFFFAOYSA-N
XLogP2.76
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.23
LogP ≤ 52.76
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-methylphenyl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine
CID 105339867
[(3-bromo-2-chlorophenyl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine
CID 105339857
[(2-bromo-6-fluorophenyl)-[4-chloro-1-(2-methoxyethyl)pyrazol-5-yl]methyl]hydrazine
CID 105280354
[(4-methoxy-1-propylpyrazol-5-yl)-(6-methyl-2-pyridinyl)methyl]hydrazine
CID 105219117
4-bromo-2-[hydrazinyl-(4-methoxy-1-propylpyrazol-5-yl)methyl]aniline
CID 105263508
1-(4-methoxy-1-propylpyrazol-5-yl)ethylhydrazine
CID 105201289
[(4-methoxy-1-propylpyrazol-5-yl)-(4-methylsulfanylphenyl)methyl]hydrazine
CID 105339854
1-(3-bromo-4-fluorophenyl)-1-(4-methoxy-1-propylpyrazol-5-yl)-N-methylmethanamine
CID 114660093
[(2,5-dibromothiophen-3-yl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine
CID 107970637
(2-bromo-6-fluorophenyl)-(4-bromo-1-propylpyrazol-5-yl)methanol
CID 114885652
[(4-methoxy-1-propylpyrazol-5-yl)-(4-methyl-3-pyridinyl)methyl]hydrazine
CID 105279840
[(4-methoxy-1-propylpyrazol-5-yl)-pyridazin-4-ylmethyl]hydrazine
CID 105339836

Frequently Asked Questions

What is the IUPAC name of [(2-bromo-6-fluorophenyl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine?
The IUPAC name of [(2-bromo-6-fluorophenyl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine (CID 105280420) is [(2-bromo-6-fluorophenyl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine.
What is the SMILES notation for [(2-bromo-6-fluorophenyl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine?
The canonical SMILES for [(2-bromo-6-fluorophenyl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine is CCCn1ncc(OC)c1C(NN)c1c(F)cccc1Br.
What is the InChIKey of [(2-bromo-6-fluorophenyl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine?
The InChIKey is OYFJINVPKDASFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18BrFN4O/c1-3-7-20-14(11(21-2)8-18-20)13(19-17)12-9(15)5-4-6-10(12)16/h4-6,8,13,19H,3,7,17H2,1-2H3.
What are the key properties of [(2-bromo-6-fluorophenyl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine?
[(2-bromo-6-fluorophenyl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine has a molecular weight of 357.23 g/mol, XLogP of 2.76, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-bromo-6-fluorophenyl)-(4-methoxy-1-propylpyrazol-5-yl)methyl]hydrazine is sourced from PubChem (CID 105280420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).