N-butyl-2-methoxy-N-propylethanesulfonamide

C10H23NO3S — CID 89281662

IUPACN-butyl-2-methoxy-N-propylethanesulfonamide
SMILESCCCCN(CCC)S(=O)(=O)CCOC
InChIInChI=1S/C10H23NO3S/c1-4-6-8-11(7-5-2)15(12,13)10-9-14-3/h4-10H2,1-3H3
InChIKeyDYXMTIMDHPLVTA-UHFFFAOYSA-N
MW237.36 g/mol
LogP1.47
Rot. Bonds9

About N-butyl-2-methoxy-N-propylethanesulfonamide

N-butyl-2-methoxy-N-propylethanesulfonamide (PubChem CID 89281662) has the molecular formula C10H23NO3S and a molecular weight of 237.36 g/mol. Its IUPAC name is N-butyl-2-methoxy-N-propylethanesulfonamide.

Molecular Properties

Compound NameN-butyl-2-methoxy-N-propylethanesulfonamide
PubChem CID89281662
Molecular FormulaC10H23NO3S
Molecular Weight237.36 g/mol
Exact Mass237.14
IUPAC NameN-butyl-2-methoxy-N-propylethanesulfonamide
SMILESCCCCN(CCC)S(=O)(=O)CCOC
InChIInChI=1S/C10H23NO3S/c1-4-6-8-11(7-5-2)15(12,13)10-9-14-3/h4-10H2,1-3H3
InChIKeyDYXMTIMDHPLVTA-UHFFFAOYSA-N
XLogP1.47
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.36
LogP ≤ 51.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-butyl-2-methoxy-N-propylethanesulfonamide?
The IUPAC name of N-butyl-2-methoxy-N-propylethanesulfonamide (CID 89281662) is N-butyl-2-methoxy-N-propylethanesulfonamide.
What is the SMILES notation for N-butyl-2-methoxy-N-propylethanesulfonamide?
The canonical SMILES for N-butyl-2-methoxy-N-propylethanesulfonamide is CCCCN(CCC)S(=O)(=O)CCOC.
What is the InChIKey of N-butyl-2-methoxy-N-propylethanesulfonamide?
The InChIKey is DYXMTIMDHPLVTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO3S/c1-4-6-8-11(7-5-2)15(12,13)10-9-14-3/h4-10H2,1-3H3.
What are the key properties of N-butyl-2-methoxy-N-propylethanesulfonamide?
N-butyl-2-methoxy-N-propylethanesulfonamide has a molecular weight of 237.36 g/mol, XLogP of 1.47, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-2-methoxy-N-propylethanesulfonamide is sourced from PubChem (CID 89281662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).