N,N-diethyl-3-hydrazinyl-6-methylsulfonylhexan-1-amine

C11H27N3O2S — CID 105243995

IUPACN,N-diethyl-3-hydrazinyl-6-methylsulfonylhexan-1-amine
SMILESCCN(CC)CCC(CCCS(C)(=O)=O)NN
InChIInChI=1S/C11H27N3O2S/c1-4-14(5-2)9-8-11(13-12)7-6-10-17(3,15)16/h11,13H,4-10,12H2,1-3H3
InChIKeyUSMZFXSEJGMMEY-UHFFFAOYSA-N
MW265.42 g/mol
LogP0.38
Rot. Bonds10

About N,N-diethyl-3-hydrazinyl-6-methylsulfonylhexan-1-amine

N,N-diethyl-3-hydrazinyl-6-methylsulfonylhexan-1-amine (PubChem CID 105243995) has the molecular formula C11H27N3O2S and a molecular weight of 265.42 g/mol. Its IUPAC name is N,N-diethyl-3-hydrazinyl-6-methylsulfonylhexan-1-amine.

Molecular Properties

Compound NameN,N-diethyl-3-hydrazinyl-6-methylsulfonylhexan-1-amine
PubChem CID105243995
Molecular FormulaC11H27N3O2S
Molecular Weight265.42 g/mol
Exact Mass265.18
IUPAC NameN,N-diethyl-3-hydrazinyl-6-methylsulfonylhexan-1-amine
SMILESCCN(CC)CCC(CCCS(C)(=O)=O)NN
InChIInChI=1S/C11H27N3O2S/c1-4-14(5-2)9-8-11(13-12)7-6-10-17(3,15)16/h11,13H,4-10,12H2,1-3H3
InChIKeyUSMZFXSEJGMMEY-UHFFFAOYSA-N
XLogP0.38
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.42
LogP ≤ 50.38
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-N,1-N,3-N-triethyl-5-methylsulfonylpentane-1,3-diamine
CID 79086946
(1,1,1-trifluoro-7-methylsulfonylheptan-4-yl)hydrazine
CID 105248920
(1-butan-2-ylsulfanyl-5-methylsulfonylpentan-2-yl)hydrazine
CID 105227073
N,N-diethyl-2-methylsulfonylethanamine
CID 11435289
(1-methoxy-2-methyl-7-methylsulfonylheptan-4-yl)hydrazine
CID 105290999
(1-methylsulfonyl-7-thiophen-2-ylheptan-4-yl)hydrazine
CID 105290949
N-ethyl-3-methyl-N-(2-methylsulfonylethyl)butan-1-amine
CID 59762109
(1,1-difluoro-5-methylsulfonylpentan-2-yl)hydrazine
CID 105265023
1-methylsulfonylhexan-2-ylhydrazine
CID 105293864
1-methylsulfonyldodecan-2-ylhydrazine
CID 105298419
(1,1,1-trifluoro-5-methylsulfonylpentan-2-yl)hydrazine
CID 105215617
(6-methylsulfonyl-1-pyridin-2-ylhexan-3-yl)hydrazine
CID 105290925

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-3-hydrazinyl-6-methylsulfonylhexan-1-amine?
The IUPAC name of N,N-diethyl-3-hydrazinyl-6-methylsulfonylhexan-1-amine (CID 105243995) is N,N-diethyl-3-hydrazinyl-6-methylsulfonylhexan-1-amine.
What is the SMILES notation for N,N-diethyl-3-hydrazinyl-6-methylsulfonylhexan-1-amine?
The canonical SMILES for N,N-diethyl-3-hydrazinyl-6-methylsulfonylhexan-1-amine is CCN(CC)CCC(CCCS(C)(=O)=O)NN.
What is the InChIKey of N,N-diethyl-3-hydrazinyl-6-methylsulfonylhexan-1-amine?
The InChIKey is USMZFXSEJGMMEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H27N3O2S/c1-4-14(5-2)9-8-11(13-12)7-6-10-17(3,15)16/h11,13H,4-10,12H2,1-3H3.
What are the key properties of N,N-diethyl-3-hydrazinyl-6-methylsulfonylhexan-1-amine?
N,N-diethyl-3-hydrazinyl-6-methylsulfonylhexan-1-amine has a molecular weight of 265.42 g/mol, XLogP of 0.38, 10 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-3-hydrazinyl-6-methylsulfonylhexan-1-amine is sourced from PubChem (CID 105243995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).