N-tert-butylmethanesulfonamide;2,2-dimethylpropane

C10H25NO2S — CID 161299007

IUPACN-tert-butylmethanesulfonamide;2,2-dimethylpropane
SMILESCC(C)(C)C.CC(C)(C)NS(C)(=O)=O
InChIInChI=1S/C5H13NO2S.C5H12/c1-5(2,3)6-9(4,7)8;1-5(2,3)4/h6H,1-4H3;1-4H3
InChIKeyVHIWBIMZZMIBSR-UHFFFAOYSA-N
MW223.38 g/mol
LogP2.39
Rot. Bonds1

About N-tert-butylmethanesulfonamide;2,2-dimethylpropane

N-tert-butylmethanesulfonamide;2,2-dimethylpropane (PubChem CID 161299007) has the molecular formula C10H25NO2S and a molecular weight of 223.38 g/mol. Its IUPAC name is N-tert-butylmethanesulfonamide;2,2-dimethylpropane.

Molecular Properties

Compound NameN-tert-butylmethanesulfonamide;2,2-dimethylpropane
PubChem CID161299007
Molecular FormulaC10H25NO2S
Molecular Weight223.38 g/mol
Exact Mass223.16
IUPAC NameN-tert-butylmethanesulfonamide;2,2-dimethylpropane
SMILESCC(C)(C)C.CC(C)(C)NS(C)(=O)=O
InChIInChI=1S/C5H13NO2S.C5H12/c1-5(2,3)6-9(4,7)8;1-5(2,3)4/h6H,1-4H3;1-4H3
InChIKeyVHIWBIMZZMIBSR-UHFFFAOYSA-N
XLogP2.39
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.38
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-tert-butylmethanesulfonamide;2,2-dimethylpropane with MolForge

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

Launch Full Analysis

Related Compounds

2-methyl-N-(trimethyl-λ4-sulfanyl)propan-2-amine
CID 155378348
azanium N-tert-butylsulfamate
CID 87696521
N'-(tert-butylsulfamoyl)-N-methylmethanediamine
CID 117126162
N-tert-butyl-2-methylsulfonylethanesulfonamide
CID 64591010
N-tert-butylmethanesulfonamide;N-tert-butyl-N-methylmethanesulfonamide;N,2-dimethylpropan-2-amine;methanol;N-propan-2-ylidenemethanesulfonamide
CID 158891629
benzene;tert-butylsulfamic acid
CID 67910902
tert-butylazanium;N-tert-butylsulfamate
CID 134113851
2-[[tert-butyl(methyl)sulfamoyl]amino]-2-methylpropane
CID 134401979
N-[4-(dimethylamino)-2,4-dimethylpentan-2-yl]methanesulfonamide
CID 89331793
N-[(2S)-1-hydroxy-2,3-dimethylbutan-2-yl]methanesulfonamide
CID 59560469
N-(2-methyl-1-pyrrol-1-ylpropan-2-yl)methanesulfonamide
CID 63858847
N-tert-butyl-3,3-difluorocyclobutane-1-sulfonamide
CID 130209119

Frequently Asked Questions

What is the IUPAC name of N-tert-butylmethanesulfonamide;2,2-dimethylpropane?
The IUPAC name of N-tert-butylmethanesulfonamide;2,2-dimethylpropane (CID 161299007) is N-tert-butylmethanesulfonamide;2,2-dimethylpropane.
What is the SMILES notation for N-tert-butylmethanesulfonamide;2,2-dimethylpropane?
The canonical SMILES for N-tert-butylmethanesulfonamide;2,2-dimethylpropane is CC(C)(C)C.CC(C)(C)NS(C)(=O)=O.
What is the InChIKey of N-tert-butylmethanesulfonamide;2,2-dimethylpropane?
The InChIKey is VHIWBIMZZMIBSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13NO2S.C5H12/c1-5(2,3)6-9(4,7)8;1-5(2,3)4/h6H,1-4H3;1-4H3.
What are the key properties of N-tert-butylmethanesulfonamide;2,2-dimethylpropane?
N-tert-butylmethanesulfonamide;2,2-dimethylpropane has a molecular weight of 223.38 g/mol, XLogP of 2.39, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butylmethanesulfonamide;2,2-dimethylpropane is sourced from PubChem (CID 161299007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).