[1-(2-bromophenyl)sulfanyl-3-cyclopentylpropan-2-yl]hydrazine

C14H21BrN2S — CID 105238071

IUPAC[1-(2-bromophenyl)sulfanyl-3-cyclopentylpropan-2-yl]hydrazine
SMILESNNC(CSc1ccccc1Br)CC1CCCC1
InChIInChI=1S/C14H21BrN2S/c15-13-7-3-4-8-14(13)18-10-12(17-16)9-11-5-1-2-6-11/h3-4,7-8,11-12,17H,1-2,5-6,9-10,16H2
InChIKeyCHEYERFAUKDRKO-UHFFFAOYSA-N
MW329.31 g/mol
LogP3.95
Rot. Bonds6

About [1-(2-bromophenyl)sulfanyl-3-cyclopentylpropan-2-yl]hydrazine

[1-(2-bromophenyl)sulfanyl-3-cyclopentylpropan-2-yl]hydrazine (PubChem CID 105238071) has the molecular formula C14H21BrN2S and a molecular weight of 329.31 g/mol. Its IUPAC name is [1-(2-bromophenyl)sulfanyl-3-cyclopentylpropan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(2-bromophenyl)sulfanyl-3-cyclopentylpropan-2-yl]hydrazine
PubChem CID105238071
Molecular FormulaC14H21BrN2S
Molecular Weight329.31 g/mol
Exact Mass328.06
IUPAC Name[1-(2-bromophenyl)sulfanyl-3-cyclopentylpropan-2-yl]hydrazine
SMILESNNC(CSc1ccccc1Br)CC1CCCC1
InChIInChI=1S/C14H21BrN2S/c15-13-7-3-4-8-14(13)18-10-12(17-16)9-11-5-1-2-6-11/h3-4,7-8,11-12,17H,1-2,5-6,9-10,16H2
InChIKeyCHEYERFAUKDRKO-UHFFFAOYSA-N
XLogP3.95
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.31
LogP ≤ 53.95
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)sulfanyl-1-cycloheptylethyl]hydrazine
CID 105238114
2-(2-bromophenyl)sulfanyl-1-cyclopentyl-N-methylethanamine
CID 66144073
[1-(2-bromophenyl)-3-cyclobutylpropan-2-yl]hydrazine
CID 105214950
[1-(2-bromophenyl)sulfanyl-4-ethylhexan-2-yl]hydrazine
CID 105238238
[1-(2-bromophenyl)sulfanyl-6-methylheptan-2-yl]hydrazine
CID 105238259
2-(2-bromophenyl)sulfanylethylcyclooctane
CID 155054934
[1-(2-bromophenyl)sulfanyl-3-(5-bromothiophen-2-yl)propan-2-yl]hydrazine
CID 105238033
[1-(2-bromophenyl)sulfanyl-3-(furan-3-yl)propan-2-yl]hydrazine
CID 105238115
1-cyclopentyl-3-(2-methylphenyl)sulfanyl-N-propylpropan-2-amine
CID 66096136
[1-(2-bromophenyl)sulfanyl-3-(3-methylphenyl)propan-2-yl]hydrazine
CID 105238103
(1-cyclohexyl-3-methylsulfanylpropan-2-yl)hydrazine
CID 105213841
[1-(3-bromo-5-fluorophenyl)-3-(2-bromophenyl)sulfanylpropan-2-yl]hydrazine
CID 105238111

Frequently Asked Questions

What is the IUPAC name of [1-(2-bromophenyl)sulfanyl-3-cyclopentylpropan-2-yl]hydrazine?
The IUPAC name of [1-(2-bromophenyl)sulfanyl-3-cyclopentylpropan-2-yl]hydrazine (CID 105238071) is [1-(2-bromophenyl)sulfanyl-3-cyclopentylpropan-2-yl]hydrazine.
What is the SMILES notation for [1-(2-bromophenyl)sulfanyl-3-cyclopentylpropan-2-yl]hydrazine?
The canonical SMILES for [1-(2-bromophenyl)sulfanyl-3-cyclopentylpropan-2-yl]hydrazine is NNC(CSc1ccccc1Br)CC1CCCC1.
What is the InChIKey of [1-(2-bromophenyl)sulfanyl-3-cyclopentylpropan-2-yl]hydrazine?
The InChIKey is CHEYERFAUKDRKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21BrN2S/c15-13-7-3-4-8-14(13)18-10-12(17-16)9-11-5-1-2-6-11/h3-4,7-8,11-12,17H,1-2,5-6,9-10,16H2.
What are the key properties of [1-(2-bromophenyl)sulfanyl-3-cyclopentylpropan-2-yl]hydrazine?
[1-(2-bromophenyl)sulfanyl-3-cyclopentylpropan-2-yl]hydrazine has a molecular weight of 329.31 g/mol, XLogP of 3.95, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-bromophenyl)sulfanyl-3-cyclopentylpropan-2-yl]hydrazine is sourced from PubChem (CID 105238071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).