N-(5-amino-2,2-dimethylpentyl)methanesulfonamide

C8H20N2O2S — CID 106141702

IUPACN-(5-amino-2,2-dimethylpentyl)methanesulfonamide
SMILESCC(C)(CCCN)CNS(C)(=O)=O
InChIInChI=1S/C8H20N2O2S/c1-8(2,5-4-6-9)7-10-13(3,11)12/h10H,4-7,9H2,1-3H3
InChIKeyVNEDLEUFWPPLQZ-UHFFFAOYSA-N
MW208.33 g/mol
LogP0.30
Rot. Bonds6

About N-(5-amino-2,2-dimethylpentyl)methanesulfonamide

N-(5-amino-2,2-dimethylpentyl)methanesulfonamide (PubChem CID 106141702) has the molecular formula C8H20N2O2S and a molecular weight of 208.33 g/mol. Its IUPAC name is N-(5-amino-2,2-dimethylpentyl)methanesulfonamide.

Molecular Properties

Compound NameN-(5-amino-2,2-dimethylpentyl)methanesulfonamide
PubChem CID106141702
Molecular FormulaC8H20N2O2S
Molecular Weight208.33 g/mol
Exact Mass208.12
IUPAC NameN-(5-amino-2,2-dimethylpentyl)methanesulfonamide
SMILESCC(C)(CCCN)CNS(C)(=O)=O
InChIInChI=1S/C8H20N2O2S/c1-8(2,5-4-6-9)7-10-13(3,11)12/h10H,4-7,9H2,1-3H3
InChIKeyVNEDLEUFWPPLQZ-UHFFFAOYSA-N
XLogP0.30
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.33
LogP ≤ 50.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(5-amino-2,2-dimethylpentyl)methanesulfonamide 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

2,2-dimethyl-N-(methylsulfamoyl)pentane-1,5-diamine
CID 106141802
N-(4-methoxy-2,2-dimethylbutyl)methanesulfonamide
CID 104624458
N-(5-amino-2,2-dimethylpentyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 106141679
N-(3-aminopropyl)methanesulfonamide
CID 18350602
N-(5-amino-2,2-dimethylpentyl)-1,1-dioxothiane-4-sulfonamide
CID 106141685
N-(4-amino-2,2-dimethylbutyl)-3,3-dimethylbutane-1-sulfonamide
CID 106141530
N-(5-amino-2,2-dimethylpentyl)-3-methylbenzenesulfonamide
CID 106141735
2,2-dimethyl-N-(propylsulfamoyl)butane-1,4-diamine
CID 106141642
N-(5-amino-2,2-dimethylpentyl)-2,2-dimethylbutanamide
CID 106140383
N-(5-amino-2,2-dimethylpentyl)-5-fluoro-2-methylbenzenesulfonamide
CID 106141876
N-(5-amino-2,2-dimethylpentyl)-2,2-dimethylpropanamide
CID 106140502
N-(2-aminoethyl)methanesulfonamide
CID 158725113

Frequently Asked Questions

What is the IUPAC name of N-(5-amino-2,2-dimethylpentyl)methanesulfonamide?
The IUPAC name of N-(5-amino-2,2-dimethylpentyl)methanesulfonamide (CID 106141702) is N-(5-amino-2,2-dimethylpentyl)methanesulfonamide.
What is the SMILES notation for N-(5-amino-2,2-dimethylpentyl)methanesulfonamide?
The canonical SMILES for N-(5-amino-2,2-dimethylpentyl)methanesulfonamide is CC(C)(CCCN)CNS(C)(=O)=O.
What is the InChIKey of N-(5-amino-2,2-dimethylpentyl)methanesulfonamide?
The InChIKey is VNEDLEUFWPPLQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20N2O2S/c1-8(2,5-4-6-9)7-10-13(3,11)12/h10H,4-7,9H2,1-3H3.
What are the key properties of N-(5-amino-2,2-dimethylpentyl)methanesulfonamide?
N-(5-amino-2,2-dimethylpentyl)methanesulfonamide has a molecular weight of 208.33 g/mol, XLogP of 0.30, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-2,2-dimethylpentyl)methanesulfonamide is sourced from PubChem (CID 106141702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).