[(5-bromofuran-2-yl)-(2-methylpyrazol-3-yl)methyl]hydrazine

C9H11BrN4O — CID 105307526

IUPAC[(5-bromofuran-2-yl)-(2-methylpyrazol-3-yl)methyl]hydrazine
SMILESCn1nccc1C(NN)c1ccc(Br)o1
InChIInChI=1S/C9H11BrN4O/c1-14-6(4-5-12-14)9(13-11)7-2-3-8(10)15-7/h2-5,9,13H,11H2,1H3
InChIKeyBOHKZEKTSABNBN-UHFFFAOYSA-N
MW271.12 g/mol
LogP1.33
Rot. Bonds3

About [(5-bromofuran-2-yl)-(2-methylpyrazol-3-yl)methyl]hydrazine

[(5-bromofuran-2-yl)-(2-methylpyrazol-3-yl)methyl]hydrazine (PubChem CID 105307526) has the molecular formula C9H11BrN4O and a molecular weight of 271.12 g/mol. Its IUPAC name is [(5-bromofuran-2-yl)-(2-methylpyrazol-3-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(5-bromofuran-2-yl)-(2-methylpyrazol-3-yl)methyl]hydrazine
PubChem CID105307526
Molecular FormulaC9H11BrN4O
Molecular Weight271.12 g/mol
Exact Mass270.01
IUPAC Name[(5-bromofuran-2-yl)-(2-methylpyrazol-3-yl)methyl]hydrazine
SMILESCn1nccc1C(NN)c1ccc(Br)o1
InChIInChI=1S/C9H11BrN4O/c1-14-6(4-5-12-14)9(13-11)7-2-3-8(10)15-7/h2-5,9,13H,11H2,1H3
InChIKeyBOHKZEKTSABNBN-UHFFFAOYSA-N
XLogP1.33
TPSA69.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.12
LogP ≤ 51.33
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

[(5-bromofuran-2-yl)-(3-methyltriazol-4-yl)methyl]hydrazine
CID 105337692
[(4-bromophenyl)-(2-methylpyrazol-3-yl)methyl]hydrazine
CID 105192289
[(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
[(2-methylpyrazol-3-yl)-(5-methylthiophen-2-yl)methyl]hydrazine
CID 105307385
[(4-chloro-1-methylpyrazol-5-yl)-(2-methylpyrazol-3-yl)methyl]hydrazine
CID 105338778
[(2-methylpyrazol-3-yl)-pyrimidin-4-ylmethyl]hydrazine
CID 105220886
[(2-methylpyrazol-3-yl)-(1-propylimidazol-2-yl)methyl]hydrazine
CID 105307580
1-(5-bromofuran-2-yl)-1-(2-ethylpyrazol-3-yl)-N-methylmethanamine
CID 115857997
[(5-ethylthiophen-2-yl)-(2-methylpyrazol-3-yl)methyl]hydrazine
CID 105307367
[(2-methylpyrazol-3-yl)-naphthalen-1-ylmethyl]hydrazine
CID 105213181
[(2-methylpyrazol-3-yl)-(thiadiazol-4-yl)methyl]hydrazine
CID 105307391

Frequently Asked Questions

What is the IUPAC name of [(5-bromofuran-2-yl)-(2-methylpyrazol-3-yl)methyl]hydrazine?
The IUPAC name of [(5-bromofuran-2-yl)-(2-methylpyrazol-3-yl)methyl]hydrazine (CID 105307526) is [(5-bromofuran-2-yl)-(2-methylpyrazol-3-yl)methyl]hydrazine.
What is the SMILES notation for [(5-bromofuran-2-yl)-(2-methylpyrazol-3-yl)methyl]hydrazine?
The canonical SMILES for [(5-bromofuran-2-yl)-(2-methylpyrazol-3-yl)methyl]hydrazine is Cn1nccc1C(NN)c1ccc(Br)o1.
What is the InChIKey of [(5-bromofuran-2-yl)-(2-methylpyrazol-3-yl)methyl]hydrazine?
The InChIKey is BOHKZEKTSABNBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11BrN4O/c1-14-6(4-5-12-14)9(13-11)7-2-3-8(10)15-7/h2-5,9,13H,11H2,1H3.
What are the key properties of [(5-bromofuran-2-yl)-(2-methylpyrazol-3-yl)methyl]hydrazine?
[(5-bromofuran-2-yl)-(2-methylpyrazol-3-yl)methyl]hydrazine has a molecular weight of 271.12 g/mol, XLogP of 1.33, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(5-bromofuran-2-yl)-(2-methylpyrazol-3-yl)methyl]hydrazine is sourced from PubChem (CID 105307526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).