N-[2-[methylsulfonyl(2-trimethoxysilylethyl)amino]ethyl]methanesulfonamide

C9H24N2O7S2Si — CID 139973986

IUPACN-[2-[methylsulfonyl(2-trimethoxysilylethyl)amino]ethyl]methanesulfonamide
SMILESCO[Si](CCN(CCNS(C)(=O)=O)S(C)(=O)=O)(OC)OC
InChIInChI=1S/C9H24N2O7S2Si/c1-16-21(17-2,18-3)9-8-11(20(5,14)15)7-6-10-19(4,12)13/h10H,6-9H2,1-5H3
InChIKeyCVOKSACKRKXJOF-UHFFFAOYSA-N
MW364.52 g/mol
LogP-1.32
Rot. Bonds11

About N-[2-[methylsulfonyl(2-trimethoxysilylethyl)amino]ethyl]methanesulfonamide

N-[2-[methylsulfonyl(2-trimethoxysilylethyl)amino]ethyl]methanesulfonamide (PubChem CID 139973986) has the molecular formula C9H24N2O7S2Si and a molecular weight of 364.52 g/mol. Its IUPAC name is N-[2-[methylsulfonyl(2-trimethoxysilylethyl)amino]ethyl]methanesulfonamide.

Molecular Properties

Compound NameN-[2-[methylsulfonyl(2-trimethoxysilylethyl)amino]ethyl]methanesulfonamide
PubChem CID139973986
Molecular FormulaC9H24N2O7S2Si
Molecular Weight364.52 g/mol
Exact Mass364.08
IUPAC NameN-[2-[methylsulfonyl(2-trimethoxysilylethyl)amino]ethyl]methanesulfonamide
SMILESCO[Si](CCN(CCNS(C)(=O)=O)S(C)(=O)=O)(OC)OC
InChIInChI=1S/C9H24N2O7S2Si/c1-16-21(17-2,18-3)9-8-11(20(5,14)15)7-6-10-19(4,12)13/h10H,6-9H2,1-5H3
InChIKeyCVOKSACKRKXJOF-UHFFFAOYSA-N
XLogP-1.32
TPSA111.24 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds11
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.52
LogP ≤ 5-1.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[2-[methylsulfonyl(2-trimethoxysilylethyl)amino]ethyl]methanesulfonamide?
The IUPAC name of N-[2-[methylsulfonyl(2-trimethoxysilylethyl)amino]ethyl]methanesulfonamide (CID 139973986) is N-[2-[methylsulfonyl(2-trimethoxysilylethyl)amino]ethyl]methanesulfonamide.
What is the SMILES notation for N-[2-[methylsulfonyl(2-trimethoxysilylethyl)amino]ethyl]methanesulfonamide?
The canonical SMILES for N-[2-[methylsulfonyl(2-trimethoxysilylethyl)amino]ethyl]methanesulfonamide is CO[Si](CCN(CCNS(C)(=O)=O)S(C)(=O)=O)(OC)OC.
What is the InChIKey of N-[2-[methylsulfonyl(2-trimethoxysilylethyl)amino]ethyl]methanesulfonamide?
The InChIKey is CVOKSACKRKXJOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H24N2O7S2Si/c1-16-21(17-2,18-3)9-8-11(20(5,14)15)7-6-10-19(4,12)13/h10H,6-9H2,1-5H3.
What are the key properties of N-[2-[methylsulfonyl(2-trimethoxysilylethyl)amino]ethyl]methanesulfonamide?
N-[2-[methylsulfonyl(2-trimethoxysilylethyl)amino]ethyl]methanesulfonamide has a molecular weight of 364.52 g/mol, XLogP of -1.32, 11 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[methylsulfonyl(2-trimethoxysilylethyl)amino]ethyl]methanesulfonamide is sourced from PubChem (CID 139973986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).