(1-butan-2-ylsulfanyl-5-methylsulfonylpentan-2-yl)hydrazine

C10H24N2O2S2 — CID 105227073

IUPAC(1-butan-2-ylsulfanyl-5-methylsulfonylpentan-2-yl)hydrazine
SMILESCCC(C)SCC(CCCS(C)(=O)=O)NN
InChIInChI=1S/C10H24N2O2S2/c1-4-9(2)15-8-10(12-11)6-5-7-16(3,13)14/h9-10,12H,4-8,11H2,1-3H3
InChIKeyGEMOTTCUBLBLOL-UHFFFAOYSA-N
MW268.45 g/mol
LogP1.17
Rot. Bonds9

About (1-butan-2-ylsulfanyl-5-methylsulfonylpentan-2-yl)hydrazine

(1-butan-2-ylsulfanyl-5-methylsulfonylpentan-2-yl)hydrazine (PubChem CID 105227073) has the molecular formula C10H24N2O2S2 and a molecular weight of 268.45 g/mol. Its IUPAC name is (1-butan-2-ylsulfanyl-5-methylsulfonylpentan-2-yl)hydrazine.

Molecular Properties

Compound Name(1-butan-2-ylsulfanyl-5-methylsulfonylpentan-2-yl)hydrazine
PubChem CID105227073
Molecular FormulaC10H24N2O2S2
Molecular Weight268.45 g/mol
Exact Mass268.13
IUPAC Name(1-butan-2-ylsulfanyl-5-methylsulfonylpentan-2-yl)hydrazine
SMILESCCC(C)SCC(CCCS(C)(=O)=O)NN
InChIInChI=1S/C10H24N2O2S2/c1-4-9(2)15-8-10(12-11)6-5-7-16(3,13)14/h9-10,12H,4-8,11H2,1-3H3
InChIKeyGEMOTTCUBLBLOL-UHFFFAOYSA-N
XLogP1.17
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.45
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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-butan-2-ylsulfanyl-5-methylsulfonylpentan-2-amine
CID 65136361
N,N-diethyl-3-hydrazinyl-6-methylsulfonylhexan-1-amine
CID 105243995
(1,1,1-trifluoro-7-methylsulfonylheptan-4-yl)hydrazine
CID 105248920
(1-methoxy-2-methyl-7-methylsulfonylheptan-4-yl)hydrazine
CID 105290999
1-methylsulfonylhexan-2-ylhydrazine
CID 105293864
1-propan-2-ylsulfanylundecan-2-ylhydrazine
CID 105226075
1-methylsulfonyldodecan-2-ylhydrazine
CID 105298419
1-propan-2-ylsulfanylnonan-2-ylhydrazine
CID 105226034
1-propan-2-ylsulfanyltetradecan-2-ylhydrazine
CID 105226035
N-ethyl-1-methylsulfonylnonan-4-amine
CID 115820293
(1,1-difluoro-5-methylsulfonylpentan-2-yl)hydrazine
CID 105265023
N-ethyl-1-methylsulfonyldodecan-4-amine
CID 115820985

Frequently Asked Questions

What is the IUPAC name of (1-butan-2-ylsulfanyl-5-methylsulfonylpentan-2-yl)hydrazine?
The IUPAC name of (1-butan-2-ylsulfanyl-5-methylsulfonylpentan-2-yl)hydrazine (CID 105227073) is (1-butan-2-ylsulfanyl-5-methylsulfonylpentan-2-yl)hydrazine.
What is the SMILES notation for (1-butan-2-ylsulfanyl-5-methylsulfonylpentan-2-yl)hydrazine?
The canonical SMILES for (1-butan-2-ylsulfanyl-5-methylsulfonylpentan-2-yl)hydrazine is CCC(C)SCC(CCCS(C)(=O)=O)NN.
What is the InChIKey of (1-butan-2-ylsulfanyl-5-methylsulfonylpentan-2-yl)hydrazine?
The InChIKey is GEMOTTCUBLBLOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2O2S2/c1-4-9(2)15-8-10(12-11)6-5-7-16(3,13)14/h9-10,12H,4-8,11H2,1-3H3.
What are the key properties of (1-butan-2-ylsulfanyl-5-methylsulfonylpentan-2-yl)hydrazine?
(1-butan-2-ylsulfanyl-5-methylsulfonylpentan-2-yl)hydrazine has a molecular weight of 268.45 g/mol, XLogP of 1.17, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (1-butan-2-ylsulfanyl-5-methylsulfonylpentan-2-yl)hydrazine is sourced from PubChem (CID 105227073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).