3,3,4,4-tetramethyl-N-(methylsulfamoyl)pentan-1-amine

C10H24N2O2S — CID 20706577

IUPAC3,3,4,4-tetramethyl-N-(methylsulfamoyl)pentan-1-amine
SMILESCNS(=O)(=O)NCCC(C)(C)C(C)(C)C
InChIInChI=1S/C10H24N2O2S/c1-9(2,3)10(4,5)7-8-12-15(13,14)11-6/h11-12H,7-8H2,1-6H3
InChIKeySZGKBCMMJZNDJC-UHFFFAOYSA-N
MW236.38 g/mol
LogP1.50
Rot. Bonds5

About 3,3,4,4-tetramethyl-N-(methylsulfamoyl)pentan-1-amine

3,3,4,4-tetramethyl-N-(methylsulfamoyl)pentan-1-amine (PubChem CID 20706577) has the molecular formula C10H24N2O2S and a molecular weight of 236.38 g/mol. Its IUPAC name is 3,3,4,4-tetramethyl-N-(methylsulfamoyl)pentan-1-amine.

Molecular Properties

Compound Name3,3,4,4-tetramethyl-N-(methylsulfamoyl)pentan-1-amine
PubChem CID20706577
Molecular FormulaC10H24N2O2S
Molecular Weight236.38 g/mol
Exact Mass236.16
IUPAC Name3,3,4,4-tetramethyl-N-(methylsulfamoyl)pentan-1-amine
SMILESCNS(=O)(=O)NCCC(C)(C)C(C)(C)C
InChIInChI=1S/C10H24N2O2S/c1-9(2,3)10(4,5)7-8-12-15(13,14)11-6/h11-12H,7-8H2,1-6H3
InChIKeySZGKBCMMJZNDJC-UHFFFAOYSA-N
XLogP1.50
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.38
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,2-dimethyl-N-(2,2,2-trifluoroethylsulfamoyl)pentane-1,5-diamine
CID 114149107
2,4,4-trimethyl-N-(2,4,4-trimethylpentylsulfamoyl)pentan-1-amine
CID 20240475
N-(4,4,5,5-tetramethylhexyl)methanesulfonamide
CID 20706667
N-(3,3,4,4-tetramethylpentyl)methanesulfonamide
CID 20774377
2,4,4-Trimethyl-1-(sulfinatoamino)pentane
CID 57421733
3,5,5-Trimethyl-1-(sulfinatoamino)hexane
CID 57421741
3-[(Dimethylsulfamoylamino)methyl]-2,2,4-trimethylpentane
CID 58124476
5,5-Dimethylhexylsulfamic acid
CID 87283510
3-[(Sulfamoylamino)methyl]heptane
CID 87574850
2,2,4-Trimethyl-1-(sulfamoylamino)pentane
CID 89105586
4,4-Dimethyl-1-(sulfinatoamino)pentane
CID 91803050
1-Propan-2-yl-1-[(sulfamoylamino)methyl]cyclopropane
CID 103743750

Frequently Asked Questions

What is the IUPAC name of 3,3,4,4-tetramethyl-N-(methylsulfamoyl)pentan-1-amine?
The IUPAC name of 3,3,4,4-tetramethyl-N-(methylsulfamoyl)pentan-1-amine (CID 20706577) is 3,3,4,4-tetramethyl-N-(methylsulfamoyl)pentan-1-amine.
What is the SMILES notation for 3,3,4,4-tetramethyl-N-(methylsulfamoyl)pentan-1-amine?
The canonical SMILES for 3,3,4,4-tetramethyl-N-(methylsulfamoyl)pentan-1-amine is CNS(=O)(=O)NCCC(C)(C)C(C)(C)C.
What is the InChIKey of 3,3,4,4-tetramethyl-N-(methylsulfamoyl)pentan-1-amine?
The InChIKey is SZGKBCMMJZNDJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2O2S/c1-9(2,3)10(4,5)7-8-12-15(13,14)11-6/h11-12H,7-8H2,1-6H3.
What are the key properties of 3,3,4,4-tetramethyl-N-(methylsulfamoyl)pentan-1-amine?
3,3,4,4-tetramethyl-N-(methylsulfamoyl)pentan-1-amine has a molecular weight of 236.38 g/mol, XLogP of 1.50, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3,4,4-tetramethyl-N-(methylsulfamoyl)pentan-1-amine is sourced from PubChem (CID 20706577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).