2-(methanesulfonamido)-3,3-dimethyl-N-(2-methylpropyl)butanamide

C11H24N2O3S — CID 71846218

IUPAC2-(methanesulfonamido)-3,3-dimethyl-N-(2-methylpropyl)butanamide
SMILESCC(C)CNC(=O)C(NS(C)(=O)=O)C(C)(C)C
InChIInChI=1S/C11H24N2O3S/c1-8(2)7-12-10(14)9(11(3,4)5)13-17(6,15)16/h8-9,13H,7H2,1-6H3,(H,12,14)
InChIKeyMLFYIQVTFUDPIP-UHFFFAOYSA-N
MW264.39 g/mol
LogP0.72
Rot. Bonds5

About 2-(methanesulfonamido)-3,3-dimethyl-N-(2-methylpropyl)butanamide

2-(methanesulfonamido)-3,3-dimethyl-N-(2-methylpropyl)butanamide (PubChem CID 71846218) has the molecular formula C11H24N2O3S and a molecular weight of 264.39 g/mol. Its IUPAC name is 2-(methanesulfonamido)-3,3-dimethyl-N-(2-methylpropyl)butanamide.

Molecular Properties

Compound Name2-(methanesulfonamido)-3,3-dimethyl-N-(2-methylpropyl)butanamide
PubChem CID71846218
Molecular FormulaC11H24N2O3S
Molecular Weight264.39 g/mol
Exact Mass264.15
IUPAC Name2-(methanesulfonamido)-3,3-dimethyl-N-(2-methylpropyl)butanamide
SMILESCC(C)CNC(=O)C(NS(C)(=O)=O)C(C)(C)C
InChIInChI=1S/C11H24N2O3S/c1-8(2)7-12-10(14)9(11(3,4)5)13-17(6,15)16/h8-9,13H,7H2,1-6H3,(H,12,14)
InChIKeyMLFYIQVTFUDPIP-UHFFFAOYSA-N
XLogP0.72
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.39
LogP ≤ 50.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(methanesulfonamido)-3,3-dimethyl-N-(2-methylpropyl)butanamide?
The IUPAC name of 2-(methanesulfonamido)-3,3-dimethyl-N-(2-methylpropyl)butanamide (CID 71846218) is 2-(methanesulfonamido)-3,3-dimethyl-N-(2-methylpropyl)butanamide.
What is the SMILES notation for 2-(methanesulfonamido)-3,3-dimethyl-N-(2-methylpropyl)butanamide?
The canonical SMILES for 2-(methanesulfonamido)-3,3-dimethyl-N-(2-methylpropyl)butanamide is CC(C)CNC(=O)C(NS(C)(=O)=O)C(C)(C)C.
What is the InChIKey of 2-(methanesulfonamido)-3,3-dimethyl-N-(2-methylpropyl)butanamide?
The InChIKey is MLFYIQVTFUDPIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O3S/c1-8(2)7-12-10(14)9(11(3,4)5)13-17(6,15)16/h8-9,13H,7H2,1-6H3,(H,12,14).
What are the key properties of 2-(methanesulfonamido)-3,3-dimethyl-N-(2-methylpropyl)butanamide?
2-(methanesulfonamido)-3,3-dimethyl-N-(2-methylpropyl)butanamide has a molecular weight of 264.39 g/mol, XLogP of 0.72, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methanesulfonamido)-3,3-dimethyl-N-(2-methylpropyl)butanamide is sourced from PubChem (CID 71846218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).