[(3-cyclobutylphenyl)-(4,5-dibromothiophen-2-yl)methyl]hydrazine

C15H16Br2N2S — CID 105342056

IUPAC[(3-cyclobutylphenyl)-(4,5-dibromothiophen-2-yl)methyl]hydrazine
SMILESNNC(c1cccc(C2CCC2)c1)c1cc(Br)c(Br)s1
InChIInChI=1S/C15H16Br2N2S/c16-12-8-13(20-15(12)17)14(19-18)11-6-2-5-10(7-11)9-3-1-4-9/h2,5-9,14,19H,1,3-4,18H2
InChIKeyJNFWBDGZWQVNBK-UHFFFAOYSA-N
MW416.18 g/mol
LogP5.09
Rot. Bonds4

About [(3-cyclobutylphenyl)-(4,5-dibromothiophen-2-yl)methyl]hydrazine

[(3-cyclobutylphenyl)-(4,5-dibromothiophen-2-yl)methyl]hydrazine (PubChem CID 105342056) has the molecular formula C15H16Br2N2S and a molecular weight of 416.18 g/mol. Its IUPAC name is [(3-cyclobutylphenyl)-(4,5-dibromothiophen-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-cyclobutylphenyl)-(4,5-dibromothiophen-2-yl)methyl]hydrazine
PubChem CID105342056
Molecular FormulaC15H16Br2N2S
Molecular Weight416.18 g/mol
Exact Mass413.94
IUPAC Name[(3-cyclobutylphenyl)-(4,5-dibromothiophen-2-yl)methyl]hydrazine
SMILESNNC(c1cccc(C2CCC2)c1)c1cc(Br)c(Br)s1
InChIInChI=1S/C15H16Br2N2S/c16-12-8-13(20-15(12)17)14(19-18)11-6-2-5-10(7-11)9-3-1-4-9/h2,5-9,14,19H,1,3-4,18H2
InChIKeyJNFWBDGZWQVNBK-UHFFFAOYSA-N
XLogP5.09
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500416.18
LogP ≤ 55.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze [(3-cyclobutylphenyl)-(4,5-dibromothiophen-2-yl)methyl]hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3-cyclobutylphenyl)-(4,5-dibromothiophen-2-yl)methanamine
CID 105053621
[(3-cyclobutylphenyl)-(4,5-dimethylthiophen-2-yl)methyl]hydrazine
CID 105341956
[(4-bromo-3-fluorophenyl)-(3-cyclobutylphenyl)methyl]hydrazine
CID 105342018
[(3-bromo-2-methylphenyl)-(3-cyclobutylphenyl)methyl]hydrazine
CID 105342034
[(2-bromo-5-fluorophenyl)-(3-cyclobutylphenyl)methyl]hydrazine
CID 105342038
4-bromo-2-[(3-cyclobutylphenyl)-hydrazinylmethyl]aniline
CID 105263441
[(3-cyclobutylphenyl)-(3,5-dimethylphenyl)methyl]hydrazine
CID 105342013
(5-bromo-4-methylthiophen-2-yl)-(3-cyclobutylphenyl)methanol
CID 115839009
[(4,5-dibromothiophen-2-yl)-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]hydrazine
CID 105302953
[(2-chlorofuran-3-yl)-(3-cyclobutylphenyl)methyl]hydrazine
CID 106694793
[(3-cyclobutylphenyl)-(5-fluoro-3-pyridinyl)methyl]hydrazine
CID 105342046
[(3-cyclobutylphenyl)-(4-ethylthiadiazol-5-yl)methyl]hydrazine
CID 105342036

Frequently Asked Questions

What is the IUPAC name of [(3-cyclobutylphenyl)-(4,5-dibromothiophen-2-yl)methyl]hydrazine?
The IUPAC name of [(3-cyclobutylphenyl)-(4,5-dibromothiophen-2-yl)methyl]hydrazine (CID 105342056) is [(3-cyclobutylphenyl)-(4,5-dibromothiophen-2-yl)methyl]hydrazine.
What is the SMILES notation for [(3-cyclobutylphenyl)-(4,5-dibromothiophen-2-yl)methyl]hydrazine?
The canonical SMILES for [(3-cyclobutylphenyl)-(4,5-dibromothiophen-2-yl)methyl]hydrazine is NNC(c1cccc(C2CCC2)c1)c1cc(Br)c(Br)s1.
What is the InChIKey of [(3-cyclobutylphenyl)-(4,5-dibromothiophen-2-yl)methyl]hydrazine?
The InChIKey is JNFWBDGZWQVNBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16Br2N2S/c16-12-8-13(20-15(12)17)14(19-18)11-6-2-5-10(7-11)9-3-1-4-9/h2,5-9,14,19H,1,3-4,18H2.
What are the key properties of [(3-cyclobutylphenyl)-(4,5-dibromothiophen-2-yl)methyl]hydrazine?
[(3-cyclobutylphenyl)-(4,5-dibromothiophen-2-yl)methyl]hydrazine has a molecular weight of 416.18 g/mol, XLogP of 5.09, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-cyclobutylphenyl)-(4,5-dibromothiophen-2-yl)methyl]hydrazine is sourced from PubChem (CID 105342056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).