[(4-bromophenyl)-(2-methylpyrazol-3-yl)methyl]hydrazine

C11H13BrN4 — CID 105192289

IUPAC[(4-bromophenyl)-(2-methylpyrazol-3-yl)methyl]hydrazine
SMILESCn1nccc1C(NN)c1ccc(Br)cc1
InChIInChI=1S/C11H13BrN4/c1-16-10(6-7-14-16)11(15-13)8-2-4-9(12)5-3-8/h2-7,11,15H,13H2,1H3
InChIKeyNEFWAQOICNXUOY-UHFFFAOYSA-N
MW281.16 g/mol
LogP1.74
Rot. Bonds3

About [(4-bromophenyl)-(2-methylpyrazol-3-yl)methyl]hydrazine

[(4-bromophenyl)-(2-methylpyrazol-3-yl)methyl]hydrazine (PubChem CID 105192289) has the molecular formula C11H13BrN4 and a molecular weight of 281.16 g/mol. Its IUPAC name is [(4-bromophenyl)-(2-methylpyrazol-3-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-bromophenyl)-(2-methylpyrazol-3-yl)methyl]hydrazine
PubChem CID105192289
Molecular FormulaC11H13BrN4
Molecular Weight281.16 g/mol
Exact Mass280.03
IUPAC Name[(4-bromophenyl)-(2-methylpyrazol-3-yl)methyl]hydrazine
SMILESCn1nccc1C(NN)c1ccc(Br)cc1
InChIInChI=1S/C11H13BrN4/c1-16-10(6-7-14-16)11(15-13)8-2-4-9(12)5-3-8/h2-7,11,15H,13H2,1H3
InChIKeyNEFWAQOICNXUOY-UHFFFAOYSA-N
XLogP1.74
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.16
LogP ≤ 51.74
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

[(5-bromofuran-2-yl)-(2-methylpyrazol-3-yl)methyl]hydrazine
CID 105307526
[(2-methylpyrazol-3-yl)-naphthalen-2-ylmethyl]hydrazine
CID 105213309
[(4-bromo-1-methylpyrazol-5-yl)-(4-bromophenyl)methyl]hydrazine
CID 105192475
[(4-chloro-1-methylpyrazol-5-yl)-(2-methylpyrazol-3-yl)methyl]hydrazine
CID 105338778
[(3-fluoro-4-methoxyphenyl)-(2-methylpyrazol-3-yl)methyl]hydrazine
CID 105303933
[(2-methylpyrazol-3-yl)-(3-methyltriazol-4-yl)methyl]hydrazine
CID 105337508
[(2-bromo-3,4-difluorophenyl)-(2-methylpyrazol-3-yl)methyl]hydrazine
CID 107541261
1-(4-ethylphenyl)-N-methyl-1-(2-methylpyrazol-3-yl)methanamine
CID 63962866
[(2-methylpyrazol-3-yl)-(5-methylthiophen-2-yl)methyl]hydrazine
CID 105307385
4-bromo-N-[1-(2-methylpyrazol-3-yl)ethyl]aniline
CID 106756876
[(2-methylpyrazol-3-yl)-pyrimidin-4-ylmethyl]hydrazine
CID 105220886
[(4-bromophenyl)-(3-propyltriazol-4-yl)methyl]hydrazine
CID 105192382

Frequently Asked Questions

What is the IUPAC name of [(4-bromophenyl)-(2-methylpyrazol-3-yl)methyl]hydrazine?
The IUPAC name of [(4-bromophenyl)-(2-methylpyrazol-3-yl)methyl]hydrazine (CID 105192289) is [(4-bromophenyl)-(2-methylpyrazol-3-yl)methyl]hydrazine.
What is the SMILES notation for [(4-bromophenyl)-(2-methylpyrazol-3-yl)methyl]hydrazine?
The canonical SMILES for [(4-bromophenyl)-(2-methylpyrazol-3-yl)methyl]hydrazine is Cn1nccc1C(NN)c1ccc(Br)cc1.
What is the InChIKey of [(4-bromophenyl)-(2-methylpyrazol-3-yl)methyl]hydrazine?
The InChIKey is NEFWAQOICNXUOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13BrN4/c1-16-10(6-7-14-16)11(15-13)8-2-4-9(12)5-3-8/h2-7,11,15H,13H2,1H3.
What are the key properties of [(4-bromophenyl)-(2-methylpyrazol-3-yl)methyl]hydrazine?
[(4-bromophenyl)-(2-methylpyrazol-3-yl)methyl]hydrazine has a molecular weight of 281.16 g/mol, XLogP of 1.74, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-bromophenyl)-(2-methylpyrazol-3-yl)methyl]hydrazine is sourced from PubChem (CID 105192289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).