N-(1-amino-2-methylpropan-2-yl)-1,1-difluoro-N-methylmethanesulfonamide

C6H14F2N2O2S — CID 62010445

IUPACN-(1-amino-2-methylpropan-2-yl)-1,1-difluoro-N-methylmethanesulfonamide
SMILESCN(C(C)(C)CN)S(=O)(=O)C(F)F
InChIInChI=1S/C6H14F2N2O2S/c1-6(2,4-9)10(3)13(11,12)5(7)8/h5H,4,9H2,1-3H3
InChIKeyXBHQZHYWHOUCBN-UHFFFAOYSA-N
MW216.25 g/mol
LogP0.21
Rot. Bonds4

About N-(1-amino-2-methylpropan-2-yl)-1,1-difluoro-N-methylmethanesulfonamide

N-(1-amino-2-methylpropan-2-yl)-1,1-difluoro-N-methylmethanesulfonamide (PubChem CID 62010445) has the molecular formula C6H14F2N2O2S and a molecular weight of 216.25 g/mol. Its IUPAC name is N-(1-amino-2-methylpropan-2-yl)-1,1-difluoro-N-methylmethanesulfonamide.

Molecular Properties

Compound NameN-(1-amino-2-methylpropan-2-yl)-1,1-difluoro-N-methylmethanesulfonamide
PubChem CID62010445
Molecular FormulaC6H14F2N2O2S
Molecular Weight216.25 g/mol
Exact Mass216.07
IUPAC NameN-(1-amino-2-methylpropan-2-yl)-1,1-difluoro-N-methylmethanesulfonamide
SMILESCN(C(C)(C)CN)S(=O)(=O)C(F)F
InChIInChI=1S/C6H14F2N2O2S/c1-6(2,4-9)10(3)13(11,12)5(7)8/h5H,4,9H2,1-3H3
InChIKeyXBHQZHYWHOUCBN-UHFFFAOYSA-N
XLogP0.21
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.25
LogP ≤ 50.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(1-amino-2-methylpropan-2-yl)-1,1-difluoro-N-methylmethanesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-methylpropan-2-yl)-1,1-difluoro-N-methylmethanesulfonamide?
The IUPAC name of N-(1-amino-2-methylpropan-2-yl)-1,1-difluoro-N-methylmethanesulfonamide (CID 62010445) is N-(1-amino-2-methylpropan-2-yl)-1,1-difluoro-N-methylmethanesulfonamide.
What is the SMILES notation for N-(1-amino-2-methylpropan-2-yl)-1,1-difluoro-N-methylmethanesulfonamide?
The canonical SMILES for N-(1-amino-2-methylpropan-2-yl)-1,1-difluoro-N-methylmethanesulfonamide is CN(C(C)(C)CN)S(=O)(=O)C(F)F.
What is the InChIKey of N-(1-amino-2-methylpropan-2-yl)-1,1-difluoro-N-methylmethanesulfonamide?
The InChIKey is XBHQZHYWHOUCBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14F2N2O2S/c1-6(2,4-9)10(3)13(11,12)5(7)8/h5H,4,9H2,1-3H3.
What are the key properties of N-(1-amino-2-methylpropan-2-yl)-1,1-difluoro-N-methylmethanesulfonamide?
N-(1-amino-2-methylpropan-2-yl)-1,1-difluoro-N-methylmethanesulfonamide has a molecular weight of 216.25 g/mol, XLogP of 0.21, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2-methylpropan-2-yl)-1,1-difluoro-N-methylmethanesulfonamide is sourced from PubChem (CID 62010445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).