N-[4-(dimethylamino)-2,4-dimethylpentan-2-yl]methanesulfonamide

C10H24N2O2S — CID 89331793

IUPACN-[4-(dimethylamino)-2,4-dimethylpentan-2-yl]methanesulfonamide
SMILESCN(C)C(C)(C)CC(C)(C)NS(C)(=O)=O
InChIInChI=1S/C10H24N2O2S/c1-9(2,11-15(7,13)14)8-10(3,4)12(5)6/h11H,8H2,1-7H3
InChIKeyKTVQBPLTONEMFS-UHFFFAOYSA-N
MW236.38 g/mol
LogP1.04
Rot. Bonds5

About N-[4-(dimethylamino)-2,4-dimethylpentan-2-yl]methanesulfonamide

N-[4-(dimethylamino)-2,4-dimethylpentan-2-yl]methanesulfonamide (PubChem CID 89331793) has the molecular formula C10H24N2O2S and a molecular weight of 236.38 g/mol. Its IUPAC name is N-[4-(dimethylamino)-2,4-dimethylpentan-2-yl]methanesulfonamide.

Molecular Properties

Compound NameN-[4-(dimethylamino)-2,4-dimethylpentan-2-yl]methanesulfonamide
PubChem CID89331793
Molecular FormulaC10H24N2O2S
Molecular Weight236.38 g/mol
Exact Mass236.16
IUPAC NameN-[4-(dimethylamino)-2,4-dimethylpentan-2-yl]methanesulfonamide
SMILESCN(C)C(C)(C)CC(C)(C)NS(C)(=O)=O
InChIInChI=1S/C10H24N2O2S/c1-9(2,11-15(7,13)14)8-10(3,4)12(5)6/h11H,8H2,1-7H3
InChIKeyKTVQBPLTONEMFS-UHFFFAOYSA-N
XLogP1.04
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.38
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[4-(dimethylamino)-2,4-dimethylpentan-2-yl]methanesulfonamide?
The IUPAC name of N-[4-(dimethylamino)-2,4-dimethylpentan-2-yl]methanesulfonamide (CID 89331793) is N-[4-(dimethylamino)-2,4-dimethylpentan-2-yl]methanesulfonamide.
What is the SMILES notation for N-[4-(dimethylamino)-2,4-dimethylpentan-2-yl]methanesulfonamide?
The canonical SMILES for N-[4-(dimethylamino)-2,4-dimethylpentan-2-yl]methanesulfonamide is CN(C)C(C)(C)CC(C)(C)NS(C)(=O)=O.
What is the InChIKey of N-[4-(dimethylamino)-2,4-dimethylpentan-2-yl]methanesulfonamide?
The InChIKey is KTVQBPLTONEMFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2O2S/c1-9(2,11-15(7,13)14)8-10(3,4)12(5)6/h11H,8H2,1-7H3.
What are the key properties of N-[4-(dimethylamino)-2,4-dimethylpentan-2-yl]methanesulfonamide?
N-[4-(dimethylamino)-2,4-dimethylpentan-2-yl]methanesulfonamide has a molecular weight of 236.38 g/mol, XLogP of 1.04, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(dimethylamino)-2,4-dimethylpentan-2-yl]methanesulfonamide is sourced from PubChem (CID 89331793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).