N-(2-methoxyethyl)-N-propan-2-ylmethanesulfonamide

C7H17NO3S — CID 82953235

IUPACN-(2-methoxyethyl)-N-propan-2-ylmethanesulfonamide
SMILESCOCCN(C(C)C)S(C)(=O)=O
InChIInChI=1S/C7H17NO3S/c1-7(2)8(5-6-11-3)12(4,9)10/h7H,5-6H2,1-4H3
InChIKeyBFQVOOHRNCACGP-UHFFFAOYSA-N
MW195.28 g/mol
LogP0.30
Rot. Bonds5

About N-(2-methoxyethyl)-N-propan-2-ylmethanesulfonamide

N-(2-methoxyethyl)-N-propan-2-ylmethanesulfonamide (PubChem CID 82953235) has the molecular formula C7H17NO3S and a molecular weight of 195.28 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-propan-2-ylmethanesulfonamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-propan-2-ylmethanesulfonamide
PubChem CID82953235
Molecular FormulaC7H17NO3S
Molecular Weight195.28 g/mol
Exact Mass195.09
IUPAC NameN-(2-methoxyethyl)-N-propan-2-ylmethanesulfonamide
SMILESCOCCN(C(C)C)S(C)(=O)=O
InChIInChI=1S/C7H17NO3S/c1-7(2)8(5-6-11-3)12(4,9)10/h7H,5-6H2,1-4H3
InChIKeyBFQVOOHRNCACGP-UHFFFAOYSA-N
XLogP0.30
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.28
LogP ≤ 50.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-propan-2-ylmethanesulfonamide?
The IUPAC name of N-(2-methoxyethyl)-N-propan-2-ylmethanesulfonamide (CID 82953235) is N-(2-methoxyethyl)-N-propan-2-ylmethanesulfonamide.
What is the SMILES notation for N-(2-methoxyethyl)-N-propan-2-ylmethanesulfonamide?
The canonical SMILES for N-(2-methoxyethyl)-N-propan-2-ylmethanesulfonamide is COCCN(C(C)C)S(C)(=O)=O.
What is the InChIKey of N-(2-methoxyethyl)-N-propan-2-ylmethanesulfonamide?
The InChIKey is BFQVOOHRNCACGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17NO3S/c1-7(2)8(5-6-11-3)12(4,9)10/h7H,5-6H2,1-4H3.
What are the key properties of N-(2-methoxyethyl)-N-propan-2-ylmethanesulfonamide?
N-(2-methoxyethyl)-N-propan-2-ylmethanesulfonamide has a molecular weight of 195.28 g/mol, XLogP of 0.30, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-propan-2-ylmethanesulfonamide is sourced from PubChem (CID 82953235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).