(3-ethyl-1-methylsulfanylpentan-2-yl)hydrazine

C8H20N2S — CID 105213735

IUPAC(3-ethyl-1-methylsulfanylpentan-2-yl)hydrazine
SMILESCCC(CC)C(CSC)NN
InChIInChI=1S/C8H20N2S/c1-4-7(5-2)8(10-9)6-11-3/h7-8,10H,4-6,9H2,1-3H3
InChIKeyMGCBITBKKPWZNS-UHFFFAOYSA-N
MW176.33 g/mol
LogP1.62
Rot. Bonds6

About (3-ethyl-1-methylsulfanylpentan-2-yl)hydrazine

(3-ethyl-1-methylsulfanylpentan-2-yl)hydrazine (PubChem CID 105213735) has the molecular formula C8H20N2S and a molecular weight of 176.33 g/mol. Its IUPAC name is (3-ethyl-1-methylsulfanylpentan-2-yl)hydrazine.

Molecular Properties

Compound Name(3-ethyl-1-methylsulfanylpentan-2-yl)hydrazine
PubChem CID105213735
Molecular FormulaC8H20N2S
Molecular Weight176.33 g/mol
Exact Mass176.13
IUPAC Name(3-ethyl-1-methylsulfanylpentan-2-yl)hydrazine
SMILESCCC(CC)C(CSC)NN
InChIInChI=1S/C8H20N2S/c1-4-7(5-2)8(10-9)6-11-3/h7-8,10H,4-6,9H2,1-3H3
InChIKeyMGCBITBKKPWZNS-UHFFFAOYSA-N
XLogP1.62
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.33
LogP ≤ 51.62
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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Frequently Asked Questions

What is the IUPAC name of (3-ethyl-1-methylsulfanylpentan-2-yl)hydrazine?
The IUPAC name of (3-ethyl-1-methylsulfanylpentan-2-yl)hydrazine (CID 105213735) is (3-ethyl-1-methylsulfanylpentan-2-yl)hydrazine.
What is the SMILES notation for (3-ethyl-1-methylsulfanylpentan-2-yl)hydrazine?
The canonical SMILES for (3-ethyl-1-methylsulfanylpentan-2-yl)hydrazine is CCC(CC)C(CSC)NN.
What is the InChIKey of (3-ethyl-1-methylsulfanylpentan-2-yl)hydrazine?
The InChIKey is MGCBITBKKPWZNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20N2S/c1-4-7(5-2)8(10-9)6-11-3/h7-8,10H,4-6,9H2,1-3H3.
What are the key properties of (3-ethyl-1-methylsulfanylpentan-2-yl)hydrazine?
(3-ethyl-1-methylsulfanylpentan-2-yl)hydrazine has a molecular weight of 176.33 g/mol, XLogP of 1.62, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethyl-1-methylsulfanylpentan-2-yl)hydrazine is sourced from PubChem (CID 105213735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).