[1-(2-bromophenyl)-3-thiophen-3-ylpropyl]hydrazine

C13H15BrN2S — CID 105208687

IUPAC[1-(2-bromophenyl)-3-thiophen-3-ylpropyl]hydrazine
SMILESNNC(CCc1ccsc1)c1ccccc1Br
InChIInChI=1S/C13H15BrN2S/c14-12-4-2-1-3-11(12)13(16-15)6-5-10-7-8-17-9-10/h1-4,7-9,13,16H,5-6,15H2
InChIKeyFMGAFZIQYMSNKP-UHFFFAOYSA-N
MW311.25 g/mol
LogP3.65
Rot. Bonds5

About [1-(2-bromophenyl)-3-thiophen-3-ylpropyl]hydrazine

[1-(2-bromophenyl)-3-thiophen-3-ylpropyl]hydrazine (PubChem CID 105208687) has the molecular formula C13H15BrN2S and a molecular weight of 311.25 g/mol. Its IUPAC name is [1-(2-bromophenyl)-3-thiophen-3-ylpropyl]hydrazine.

Molecular Properties

Compound Name[1-(2-bromophenyl)-3-thiophen-3-ylpropyl]hydrazine
PubChem CID105208687
Molecular FormulaC13H15BrN2S
Molecular Weight311.25 g/mol
Exact Mass310.01
IUPAC Name[1-(2-bromophenyl)-3-thiophen-3-ylpropyl]hydrazine
SMILESNNC(CCc1ccsc1)c1ccccc1Br
InChIInChI=1S/C13H15BrN2S/c14-12-4-2-1-3-11(12)13(16-15)6-5-10-7-8-17-9-10/h1-4,7-9,13,16H,5-6,15H2
InChIKeyFMGAFZIQYMSNKP-UHFFFAOYSA-N
XLogP3.65
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.25
LogP ≤ 53.65
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'}

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Related Compounds

(1-naphthalen-1-yl-3-thiophen-3-ylpropyl)hydrazine
CID 105213252
2-(2-bromophenyl)-N-methyl-4-thiophen-3-ylbutan-1-amine
CID 79449305
[1-(5-bromothiophen-3-yl)-3-thiophen-3-ylpropyl]hydrazine
CID 105306858
4-(1-hydrazinyl-3-thiophen-3-ylpropyl)-1H-pyrazol-5-amine
CID 105231214
[1-(2,5-dichlorophenyl)-3-thiophen-3-ylpropyl]hydrazine
CID 105306748
1-(3-bromo-2-methylphenyl)-3-thiophen-3-ylpropan-1-amine
CID 115857115
(1-pyridin-3-yl-3-thiophen-3-ylpropyl)hydrazine
CID 105196206
1-(2-bromo-4-chlorophenyl)-N-methyl-3-thiophen-3-ylpropan-1-amine
CID 107993221
1,4-di(thiophen-3-yl)butan-2-ylhydrazine
CID 105306843
[1-(2-bromo-4-fluorophenyl)-2-thiophen-3-ylethyl]hydrazine
CID 105297744
(4-phenyl-1-thiophen-3-ylbutan-2-yl)hydrazine
CID 105205761
[1-(1-methylpyrazol-3-yl)-3-thiophen-3-ylpropyl]hydrazine
CID 105228749

Frequently Asked Questions

What is the IUPAC name of [1-(2-bromophenyl)-3-thiophen-3-ylpropyl]hydrazine?
The IUPAC name of [1-(2-bromophenyl)-3-thiophen-3-ylpropyl]hydrazine (CID 105208687) is [1-(2-bromophenyl)-3-thiophen-3-ylpropyl]hydrazine.
What is the SMILES notation for [1-(2-bromophenyl)-3-thiophen-3-ylpropyl]hydrazine?
The canonical SMILES for [1-(2-bromophenyl)-3-thiophen-3-ylpropyl]hydrazine is NNC(CCc1ccsc1)c1ccccc1Br.
What is the InChIKey of [1-(2-bromophenyl)-3-thiophen-3-ylpropyl]hydrazine?
The InChIKey is FMGAFZIQYMSNKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15BrN2S/c14-12-4-2-1-3-11(12)13(16-15)6-5-10-7-8-17-9-10/h1-4,7-9,13,16H,5-6,15H2.
What are the key properties of [1-(2-bromophenyl)-3-thiophen-3-ylpropyl]hydrazine?
[1-(2-bromophenyl)-3-thiophen-3-ylpropyl]hydrazine has a molecular weight of 311.25 g/mol, XLogP of 3.65, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-bromophenyl)-3-thiophen-3-ylpropyl]hydrazine is sourced from PubChem (CID 105208687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).