N-ethyl-N-(2-propan-2-yloxyethyl)methanesulfonamide

C8H19NO3S — CID 118241668

IUPACN-ethyl-N-(2-propan-2-yloxyethyl)methanesulfonamide
SMILESCCN(CCOC(C)C)S(C)(=O)=O
InChIInChI=1S/C8H19NO3S/c1-5-9(13(4,10)11)6-7-12-8(2)3/h8H,5-7H2,1-4H3
InChIKeyMJNHIKPBDHXZPF-UHFFFAOYSA-N
MW209.31 g/mol
LogP0.69
Rot. Bonds6

About N-ethyl-N-(2-propan-2-yloxyethyl)methanesulfonamide

N-ethyl-N-(2-propan-2-yloxyethyl)methanesulfonamide (PubChem CID 118241668) has the molecular formula C8H19NO3S and a molecular weight of 209.31 g/mol. Its IUPAC name is N-ethyl-N-(2-propan-2-yloxyethyl)methanesulfonamide.

Molecular Properties

Compound NameN-ethyl-N-(2-propan-2-yloxyethyl)methanesulfonamide
PubChem CID118241668
Molecular FormulaC8H19NO3S
Molecular Weight209.31 g/mol
Exact Mass209.11
IUPAC NameN-ethyl-N-(2-propan-2-yloxyethyl)methanesulfonamide
SMILESCCN(CCOC(C)C)S(C)(=O)=O
InChIInChI=1S/C8H19NO3S/c1-5-9(13(4,10)11)6-7-12-8(2)3/h8H,5-7H2,1-4H3
InChIKeyMJNHIKPBDHXZPF-UHFFFAOYSA-N
XLogP0.69
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.31
LogP ≤ 50.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(2-propan-2-yloxyethyl)methanesulfonamide?
The IUPAC name of N-ethyl-N-(2-propan-2-yloxyethyl)methanesulfonamide (CID 118241668) is N-ethyl-N-(2-propan-2-yloxyethyl)methanesulfonamide.
What is the SMILES notation for N-ethyl-N-(2-propan-2-yloxyethyl)methanesulfonamide?
The canonical SMILES for N-ethyl-N-(2-propan-2-yloxyethyl)methanesulfonamide is CCN(CCOC(C)C)S(C)(=O)=O.
What is the InChIKey of N-ethyl-N-(2-propan-2-yloxyethyl)methanesulfonamide?
The InChIKey is MJNHIKPBDHXZPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO3S/c1-5-9(13(4,10)11)6-7-12-8(2)3/h8H,5-7H2,1-4H3.
What are the key properties of N-ethyl-N-(2-propan-2-yloxyethyl)methanesulfonamide?
N-ethyl-N-(2-propan-2-yloxyethyl)methanesulfonamide has a molecular weight of 209.31 g/mol, XLogP of 0.69, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2-propan-2-yloxyethyl)methanesulfonamide is sourced from PubChem (CID 118241668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).