N-ethyl-2-(methanesulfonamido)butanamide

C7H16N2O3S — CID 20646793

IUPACN-ethyl-2-(methanesulfonamido)butanamide
SMILESCCNC(=O)C(CC)NS(C)(=O)=O
InChIInChI=1S/C7H16N2O3S/c1-4-6(7(10)8-5-2)9-13(3,11)12/h6,9H,4-5H2,1-3H3,(H,8,10)
InChIKeyMOPXPNDOFYFOMY-UHFFFAOYSA-N
MW208.28 g/mol
LogP-0.55
Rot. Bonds5

About N-ethyl-2-(methanesulfonamido)butanamide

N-ethyl-2-(methanesulfonamido)butanamide (PubChem CID 20646793) has the molecular formula C7H16N2O3S and a molecular weight of 208.28 g/mol. Its IUPAC name is N-ethyl-2-(methanesulfonamido)butanamide.

Molecular Properties

Compound NameN-ethyl-2-(methanesulfonamido)butanamide
PubChem CID20646793
Molecular FormulaC7H16N2O3S
Molecular Weight208.28 g/mol
Exact Mass208.09
IUPAC NameN-ethyl-2-(methanesulfonamido)butanamide
SMILESCCNC(=O)C(CC)NS(C)(=O)=O
InChIInChI=1S/C7H16N2O3S/c1-4-6(7(10)8-5-2)9-13(3,11)12/h6,9H,4-5H2,1-3H3,(H,8,10)
InChIKeyMOPXPNDOFYFOMY-UHFFFAOYSA-N
XLogP-0.55
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.28
LogP ≤ 5-0.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(methanesulfonamido)butanamide?
The IUPAC name of N-ethyl-2-(methanesulfonamido)butanamide (CID 20646793) is N-ethyl-2-(methanesulfonamido)butanamide.
What is the SMILES notation for N-ethyl-2-(methanesulfonamido)butanamide?
The canonical SMILES for N-ethyl-2-(methanesulfonamido)butanamide is CCNC(=O)C(CC)NS(C)(=O)=O.
What is the InChIKey of N-ethyl-2-(methanesulfonamido)butanamide?
The InChIKey is MOPXPNDOFYFOMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O3S/c1-4-6(7(10)8-5-2)9-13(3,11)12/h6,9H,4-5H2,1-3H3,(H,8,10).
What are the key properties of N-ethyl-2-(methanesulfonamido)butanamide?
N-ethyl-2-(methanesulfonamido)butanamide has a molecular weight of 208.28 g/mol, XLogP of -0.55, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(methanesulfonamido)butanamide is sourced from PubChem (CID 20646793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).