(1-cyclohexylsulfanyl-5-methoxy-5-methylhexan-2-yl)hydrazine

C14H30N2OS — CID 103026778

IUPAC(1-cyclohexylsulfanyl-5-methoxy-5-methylhexan-2-yl)hydrazine
SMILESCOC(C)(C)CCC(CSC1CCCCC1)NN
InChIInChI=1S/C14H30N2OS/c1-14(2,17-3)10-9-12(16-15)11-18-13-7-5-4-6-8-13/h12-13,16H,4-11,15H2,1-3H3
InChIKeyQZFCDSVKCSXUQU-UHFFFAOYSA-N
MW274.47 g/mol
LogP3.09
Rot. Bonds8

About (1-cyclohexylsulfanyl-5-methoxy-5-methylhexan-2-yl)hydrazine

(1-cyclohexylsulfanyl-5-methoxy-5-methylhexan-2-yl)hydrazine (PubChem CID 103026778) has the molecular formula C14H30N2OS and a molecular weight of 274.47 g/mol. Its IUPAC name is (1-cyclohexylsulfanyl-5-methoxy-5-methylhexan-2-yl)hydrazine.

Molecular Properties

Compound Name(1-cyclohexylsulfanyl-5-methoxy-5-methylhexan-2-yl)hydrazine
PubChem CID103026778
Molecular FormulaC14H30N2OS
Molecular Weight274.47 g/mol
Exact Mass274.21
IUPAC Name(1-cyclohexylsulfanyl-5-methoxy-5-methylhexan-2-yl)hydrazine
SMILESCOC(C)(C)CCC(CSC1CCCCC1)NN
InChIInChI=1S/C14H30N2OS/c1-14(2,17-3)10-9-12(16-15)11-18-13-7-5-4-6-8-13/h12-13,16H,4-11,15H2,1-3H3
InChIKeyQZFCDSVKCSXUQU-UHFFFAOYSA-N
XLogP3.09
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.47
LogP ≤ 53.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (1-cyclohexylsulfanyl-5-methoxy-5-methylhexan-2-yl)hydrazine?
The IUPAC name of (1-cyclohexylsulfanyl-5-methoxy-5-methylhexan-2-yl)hydrazine (CID 103026778) is (1-cyclohexylsulfanyl-5-methoxy-5-methylhexan-2-yl)hydrazine.
What is the SMILES notation for (1-cyclohexylsulfanyl-5-methoxy-5-methylhexan-2-yl)hydrazine?
The canonical SMILES for (1-cyclohexylsulfanyl-5-methoxy-5-methylhexan-2-yl)hydrazine is COC(C)(C)CCC(CSC1CCCCC1)NN.
What is the InChIKey of (1-cyclohexylsulfanyl-5-methoxy-5-methylhexan-2-yl)hydrazine?
The InChIKey is QZFCDSVKCSXUQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2OS/c1-14(2,17-3)10-9-12(16-15)11-18-13-7-5-4-6-8-13/h12-13,16H,4-11,15H2,1-3H3.
What are the key properties of (1-cyclohexylsulfanyl-5-methoxy-5-methylhexan-2-yl)hydrazine?
(1-cyclohexylsulfanyl-5-methoxy-5-methylhexan-2-yl)hydrazine has a molecular weight of 274.47 g/mol, XLogP of 3.09, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1-cyclohexylsulfanyl-5-methoxy-5-methylhexan-2-yl)hydrazine is sourced from PubChem (CID 103026778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).