[1-cyclohexylsulfanyl-3-(2,6-dichlorophenyl)propan-2-yl]hydrazine

C15H22Cl2N2S — CID 105227721

IUPAC[1-cyclohexylsulfanyl-3-(2,6-dichlorophenyl)propan-2-yl]hydrazine
SMILESNNC(CSC1CCCCC1)Cc1c(Cl)cccc1Cl
InChIInChI=1S/C15H22Cl2N2S/c16-14-7-4-8-15(17)13(14)9-11(19-18)10-20-12-5-2-1-3-6-12/h4,7-8,11-12,19H,1-3,5-6,9-10,18H2
InChIKeyQQCGGGZXVCJGRQ-UHFFFAOYSA-N
MW333.33 g/mol
LogP4.43
Rot. Bonds6

About [1-cyclohexylsulfanyl-3-(2,6-dichlorophenyl)propan-2-yl]hydrazine

[1-cyclohexylsulfanyl-3-(2,6-dichlorophenyl)propan-2-yl]hydrazine (PubChem CID 105227721) has the molecular formula C15H22Cl2N2S and a molecular weight of 333.33 g/mol. Its IUPAC name is [1-cyclohexylsulfanyl-3-(2,6-dichlorophenyl)propan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-cyclohexylsulfanyl-3-(2,6-dichlorophenyl)propan-2-yl]hydrazine
PubChem CID105227721
Molecular FormulaC15H22Cl2N2S
Molecular Weight333.33 g/mol
Exact Mass332.09
IUPAC Name[1-cyclohexylsulfanyl-3-(2,6-dichlorophenyl)propan-2-yl]hydrazine
SMILESNNC(CSC1CCCCC1)Cc1c(Cl)cccc1Cl
InChIInChI=1S/C15H22Cl2N2S/c16-14-7-4-8-15(17)13(14)9-11(19-18)10-20-12-5-2-1-3-6-12/h4,7-8,11-12,19H,1-3,5-6,9-10,18H2
InChIKeyQQCGGGZXVCJGRQ-UHFFFAOYSA-N
XLogP4.43
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.33
LogP ≤ 54.43
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-(4-chloro-3-fluorophenyl)-3-cyclohexylsulfanylpropan-2-yl]hydrazine
CID 107895084
[1-cyclopentylsulfanyl-3-(2,5-dichlorophenyl)propan-2-yl]hydrazine
CID 105227623
(1-cyclopentylsulfanyl-3-naphthalen-1-ylpropan-2-yl)hydrazine
CID 105227571
(1-cyclohexylsulfanyl-3-thiophen-3-ylpropan-2-yl)hydrazine
CID 105227893
[1-cyclopentylsulfanyl-3-(4-methylphenyl)propan-2-yl]hydrazine
CID 105227574
[1-(2-bromo-3-fluorophenyl)-3-cyclopentylsulfanylpropan-2-yl]hydrazine
CID 105227417
[1-cyclohexylsulfanyl-3-(3,5-dimethylphenyl)propan-2-yl]hydrazine
CID 105227768
[1-cyclohexylsulfanyl-3-(3,4-dimethylphenyl)propan-2-yl]hydrazine
CID 105227835
[1-cyclopentylsulfanyl-3-[3-(trifluoromethyl)phenyl]propan-2-yl]hydrazine
CID 105227477
(1-cyclohexyl-3-cyclopentylsulfanylpropan-2-yl)hydrazine
CID 105227439
[1-(2-bromo-5-fluorophenyl)-3-cyclohexylsulfanylpropan-2-yl]hydrazine
CID 105227890
1-cyclohexylsulfanyl-3-(2,6-difluorophenyl)-N-ethylpropan-2-amine
CID 114932112

Frequently Asked Questions

What is the IUPAC name of [1-cyclohexylsulfanyl-3-(2,6-dichlorophenyl)propan-2-yl]hydrazine?
The IUPAC name of [1-cyclohexylsulfanyl-3-(2,6-dichlorophenyl)propan-2-yl]hydrazine (CID 105227721) is [1-cyclohexylsulfanyl-3-(2,6-dichlorophenyl)propan-2-yl]hydrazine.
What is the SMILES notation for [1-cyclohexylsulfanyl-3-(2,6-dichlorophenyl)propan-2-yl]hydrazine?
The canonical SMILES for [1-cyclohexylsulfanyl-3-(2,6-dichlorophenyl)propan-2-yl]hydrazine is NNC(CSC1CCCCC1)Cc1c(Cl)cccc1Cl.
What is the InChIKey of [1-cyclohexylsulfanyl-3-(2,6-dichlorophenyl)propan-2-yl]hydrazine?
The InChIKey is QQCGGGZXVCJGRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22Cl2N2S/c16-14-7-4-8-15(17)13(14)9-11(19-18)10-20-12-5-2-1-3-6-12/h4,7-8,11-12,19H,1-3,5-6,9-10,18H2.
What are the key properties of [1-cyclohexylsulfanyl-3-(2,6-dichlorophenyl)propan-2-yl]hydrazine?
[1-cyclohexylsulfanyl-3-(2,6-dichlorophenyl)propan-2-yl]hydrazine has a molecular weight of 333.33 g/mol, XLogP of 4.43, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-cyclohexylsulfanyl-3-(2,6-dichlorophenyl)propan-2-yl]hydrazine is sourced from PubChem (CID 105227721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).