[(4-bromothiophen-2-yl)-(1-ethylpyrazol-4-yl)methyl]hydrazine

C10H13BrN4S — CID 105222445

IUPAC[(4-bromothiophen-2-yl)-(1-ethylpyrazol-4-yl)methyl]hydrazine
SMILESCCn1cc(C(NN)c2cc(Br)cs2)cn1
InChIInChI=1S/C10H13BrN4S/c1-2-15-5-7(4-13-15)10(14-12)9-3-8(11)6-16-9/h3-6,10,14H,2,12H2,1H3
InChIKeyFYQFAFQRZGGEJA-UHFFFAOYSA-N
MW301.21 g/mol
LogP2.28
Rot. Bonds4

About [(4-bromothiophen-2-yl)-(1-ethylpyrazol-4-yl)methyl]hydrazine

[(4-bromothiophen-2-yl)-(1-ethylpyrazol-4-yl)methyl]hydrazine (PubChem CID 105222445) has the molecular formula C10H13BrN4S and a molecular weight of 301.21 g/mol. Its IUPAC name is [(4-bromothiophen-2-yl)-(1-ethylpyrazol-4-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-bromothiophen-2-yl)-(1-ethylpyrazol-4-yl)methyl]hydrazine
PubChem CID105222445
Molecular FormulaC10H13BrN4S
Molecular Weight301.21 g/mol
Exact Mass300.00
IUPAC Name[(4-bromothiophen-2-yl)-(1-ethylpyrazol-4-yl)methyl]hydrazine
SMILESCCn1cc(C(NN)c2cc(Br)cs2)cn1
InChIInChI=1S/C10H13BrN4S/c1-2-15-5-7(4-13-15)10(14-12)9-3-8(11)6-16-9/h3-6,10,14H,2,12H2,1H3
InChIKeyFYQFAFQRZGGEJA-UHFFFAOYSA-N
XLogP2.28
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.21
LogP ≤ 52.28
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-bromophenyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine
CID 105197955
[(1-ethylpyrazol-4-yl)-thieno[3,2-b]thiophen-5-ylmethyl]hydrazine
CID 105289938
[(1-ethylpyrazol-4-yl)-(5-ethylthiophen-2-yl)methyl]hydrazine
CID 105289750
[(1-ethylpyrazol-4-yl)-(thiadiazol-4-yl)methyl]hydrazine
CID 105289774
[(3,5-dichlorophenyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine
CID 105289840
[(4-bromo-3-chlorophenyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine
CID 105289852
[(1-ethylpyrazol-4-yl)-(5-fluoro-1-benzothiophen-2-yl)methyl]hydrazine
CID 105289843
[(1-ethylpyrazol-4-yl)-(4-methylphenyl)methyl]hydrazine
CID 105194304
[(1-ethylpyrazol-4-yl)-(1-methylpyrazol-3-yl)methyl]hydrazine
CID 105228657
[(3,4-dimethylphenyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine
CID 105289747
[(5-bromothiophen-2-yl)-(1-propylpyrazol-4-yl)methyl]hydrazine
CID 105222098
[(2-bromo-5-methoxyphenyl)-(1-ethylpyrazol-4-yl)methyl]hydrazine
CID 105289879

Frequently Asked Questions

What is the IUPAC name of [(4-bromothiophen-2-yl)-(1-ethylpyrazol-4-yl)methyl]hydrazine?
The IUPAC name of [(4-bromothiophen-2-yl)-(1-ethylpyrazol-4-yl)methyl]hydrazine (CID 105222445) is [(4-bromothiophen-2-yl)-(1-ethylpyrazol-4-yl)methyl]hydrazine.
What is the SMILES notation for [(4-bromothiophen-2-yl)-(1-ethylpyrazol-4-yl)methyl]hydrazine?
The canonical SMILES for [(4-bromothiophen-2-yl)-(1-ethylpyrazol-4-yl)methyl]hydrazine is CCn1cc(C(NN)c2cc(Br)cs2)cn1.
What is the InChIKey of [(4-bromothiophen-2-yl)-(1-ethylpyrazol-4-yl)methyl]hydrazine?
The InChIKey is FYQFAFQRZGGEJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13BrN4S/c1-2-15-5-7(4-13-15)10(14-12)9-3-8(11)6-16-9/h3-6,10,14H,2,12H2,1H3.
What are the key properties of [(4-bromothiophen-2-yl)-(1-ethylpyrazol-4-yl)methyl]hydrazine?
[(4-bromothiophen-2-yl)-(1-ethylpyrazol-4-yl)methyl]hydrazine has a molecular weight of 301.21 g/mol, XLogP of 2.28, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-bromothiophen-2-yl)-(1-ethylpyrazol-4-yl)methyl]hydrazine is sourced from PubChem (CID 105222445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).