N-(ethyl-dimethyl-oxo-λ6-sulfanyl)ethanamine

C6H17NOS — CID 57294750

IUPACN-(ethyl-dimethyl-oxo-λ6-sulfanyl)ethanamine
SMILESCCNS(C)(C)(=O)CC
InChIInChI=1S/C6H17NOS/c1-5-7-9(3,4,8)6-2/h5-6H2,1-4H3,(H,7,8)
InChIKeyIGYFWMZIKDJWGQ-UHFFFAOYSA-N
MW151.27 g/mol
LogP0.61
Rot. Bonds3

About N-(ethyl-dimethyl-oxo-λ6-sulfanyl)ethanamine

N-(ethyl-dimethyl-oxo-λ6-sulfanyl)ethanamine (PubChem CID 57294750) has the molecular formula C6H17NOS and a molecular weight of 151.27 g/mol. Its IUPAC name is N-(ethyl-dimethyl-oxo-λ6-sulfanyl)ethanamine.

Molecular Properties

Compound NameN-(ethyl-dimethyl-oxo-λ6-sulfanyl)ethanamine
PubChem CID57294750
Molecular FormulaC6H17NOS
Molecular Weight151.27 g/mol
Exact Mass151.10
IUPAC NameN-(ethyl-dimethyl-oxo-λ6-sulfanyl)ethanamine
SMILESCCNS(C)(C)(=O)CC
InChIInChI=1S/C6H17NOS/c1-5-7-9(3,4,8)6-2/h5-6H2,1-4H3,(H,7,8)
InChIKeyIGYFWMZIKDJWGQ-UHFFFAOYSA-N
XLogP0.61
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.27
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(ethyl-dimethyl-oxo-λ6-sulfanyl)ethanamine?
The IUPAC name of N-(ethyl-dimethyl-oxo-λ6-sulfanyl)ethanamine (CID 57294750) is N-(ethyl-dimethyl-oxo-λ6-sulfanyl)ethanamine.
What is the SMILES notation for N-(ethyl-dimethyl-oxo-λ6-sulfanyl)ethanamine?
The canonical SMILES for N-(ethyl-dimethyl-oxo-λ6-sulfanyl)ethanamine is CCNS(C)(C)(=O)CC.
What is the InChIKey of N-(ethyl-dimethyl-oxo-λ6-sulfanyl)ethanamine?
The InChIKey is IGYFWMZIKDJWGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H17NOS/c1-5-7-9(3,4,8)6-2/h5-6H2,1-4H3,(H,7,8).
What are the key properties of N-(ethyl-dimethyl-oxo-λ6-sulfanyl)ethanamine?
N-(ethyl-dimethyl-oxo-λ6-sulfanyl)ethanamine has a molecular weight of 151.27 g/mol, XLogP of 0.61, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(ethyl-dimethyl-oxo-λ6-sulfanyl)ethanamine is sourced from PubChem (CID 57294750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).