[2-(4-bromophenyl)sulfanyl-1-(2-phenylcyclopropyl)ethyl]hydrazine

C17H19BrN2S — CID 105236080

IUPAC[2-(4-bromophenyl)sulfanyl-1-(2-phenylcyclopropyl)ethyl]hydrazine
SMILESNNC(CSc1ccc(Br)cc1)C1CC1c1ccccc1
InChIInChI=1S/C17H19BrN2S/c18-13-6-8-14(9-7-13)21-11-17(20-19)16-10-15(16)12-4-2-1-3-5-12/h1-9,15-17,20H,10-11,19H2
InChIKeyQPQWXUYDBMZLON-UHFFFAOYSA-N
MW363.32 g/mol
LogP4.18
Rot. Bonds6

About [2-(4-bromophenyl)sulfanyl-1-(2-phenylcyclopropyl)ethyl]hydrazine

[2-(4-bromophenyl)sulfanyl-1-(2-phenylcyclopropyl)ethyl]hydrazine (PubChem CID 105236080) has the molecular formula C17H19BrN2S and a molecular weight of 363.32 g/mol. Its IUPAC name is [2-(4-bromophenyl)sulfanyl-1-(2-phenylcyclopropyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(4-bromophenyl)sulfanyl-1-(2-phenylcyclopropyl)ethyl]hydrazine
PubChem CID105236080
Molecular FormulaC17H19BrN2S
Molecular Weight363.32 g/mol
Exact Mass362.05
IUPAC Name[2-(4-bromophenyl)sulfanyl-1-(2-phenylcyclopropyl)ethyl]hydrazine
SMILESNNC(CSc1ccc(Br)cc1)C1CC1c1ccccc1
InChIInChI=1S/C17H19BrN2S/c18-13-6-8-14(9-7-13)21-11-17(20-19)16-10-15(16)12-4-2-1-3-5-12/h1-9,15-17,20H,10-11,19H2
InChIKeyQPQWXUYDBMZLON-UHFFFAOYSA-N
XLogP4.18
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.32
LogP ≤ 54.18
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

[2-(2-bromophenyl)-1-(2-phenylcyclopropyl)ethyl]hydrazine
CID 105215061
[2-(5-bromo-2-pyridinyl)-1-(2-phenylcyclopropyl)ethyl]hydrazine
CID 105334602
[2-(4-bromo-2-chlorophenyl)-1-(2-phenylcyclopropyl)ethyl]hydrazine
CID 105335247
[2-(4-bromophenyl)sulfanyl-1-phenylethyl]hydrazine
CID 105235850
[2-(5-bromo-3-pyridinyl)-1-(2-phenylcyclopropyl)ethyl]hydrazine
CID 105334805
1-(2-phenylcyclopropyl)but-3-ynylhydrazine
CID 105281555
[2-ethoxy-1-(2-phenylcyclopropyl)ethyl]hydrazine
CID 105235457
2-(4-bromophenyl)-N-ethyl-2-(2-phenylcyclopropyl)ethanamine
CID 116518136
[3-methoxy-1-(2-phenylcyclopropyl)butyl]hydrazine
CID 105267261
[2-(3,4-difluorophenyl)-1-(2-phenylcyclopropyl)ethyl]hydrazine
CID 105330409
[2-(4-methoxyphenyl)-1-(2-phenylcyclopropyl)ethyl]hydrazine
CID 105205565
[3-(oxan-2-yl)-1-(2-phenylcyclopropyl)propyl]hydrazine
CID 105341453

Frequently Asked Questions

What is the IUPAC name of [2-(4-bromophenyl)sulfanyl-1-(2-phenylcyclopropyl)ethyl]hydrazine?
The IUPAC name of [2-(4-bromophenyl)sulfanyl-1-(2-phenylcyclopropyl)ethyl]hydrazine (CID 105236080) is [2-(4-bromophenyl)sulfanyl-1-(2-phenylcyclopropyl)ethyl]hydrazine.
What is the SMILES notation for [2-(4-bromophenyl)sulfanyl-1-(2-phenylcyclopropyl)ethyl]hydrazine?
The canonical SMILES for [2-(4-bromophenyl)sulfanyl-1-(2-phenylcyclopropyl)ethyl]hydrazine is NNC(CSc1ccc(Br)cc1)C1CC1c1ccccc1.
What is the InChIKey of [2-(4-bromophenyl)sulfanyl-1-(2-phenylcyclopropyl)ethyl]hydrazine?
The InChIKey is QPQWXUYDBMZLON-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19BrN2S/c18-13-6-8-14(9-7-13)21-11-17(20-19)16-10-15(16)12-4-2-1-3-5-12/h1-9,15-17,20H,10-11,19H2.
What are the key properties of [2-(4-bromophenyl)sulfanyl-1-(2-phenylcyclopropyl)ethyl]hydrazine?
[2-(4-bromophenyl)sulfanyl-1-(2-phenylcyclopropyl)ethyl]hydrazine has a molecular weight of 363.32 g/mol, XLogP of 4.18, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-bromophenyl)sulfanyl-1-(2-phenylcyclopropyl)ethyl]hydrazine is sourced from PubChem (CID 105236080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).