N-cyclooctyl-2-[methyl(methylsulfonyl)amino]acetamide

C12H24N2O3S — CID 30464713

IUPACN-cyclooctyl-2-[methyl(methylsulfonyl)amino]acetamide
SMILESCN(CC(=O)NC1CCCCCCC1)S(C)(=O)=O
InChIInChI=1S/C12H24N2O3S/c1-14(18(2,16)17)10-12(15)13-11-8-6-4-3-5-7-9-11/h11H,3-10H2,1-2H3,(H,13,15)
InChIKeyONVMWUICTAHGMJ-UHFFFAOYSA-N
MW276.40 g/mol
LogP1.11
Rot. Bonds4

About N-cyclooctyl-2-[methyl(methylsulfonyl)amino]acetamide

N-cyclooctyl-2-[methyl(methylsulfonyl)amino]acetamide (PubChem CID 30464713) has the molecular formula C12H24N2O3S and a molecular weight of 276.40 g/mol. Its IUPAC name is N-cyclooctyl-2-[methyl(methylsulfonyl)amino]acetamide.

Molecular Properties

Compound NameN-cyclooctyl-2-[methyl(methylsulfonyl)amino]acetamide
PubChem CID30464713
Molecular FormulaC12H24N2O3S
Molecular Weight276.40 g/mol
Exact Mass276.15
IUPAC NameN-cyclooctyl-2-[methyl(methylsulfonyl)amino]acetamide
SMILESCN(CC(=O)NC1CCCCCCC1)S(C)(=O)=O
InChIInChI=1S/C12H24N2O3S/c1-14(18(2,16)17)10-12(15)13-11-8-6-4-3-5-7-9-11/h11H,3-10H2,1-2H3,(H,13,15)
InChIKeyONVMWUICTAHGMJ-UHFFFAOYSA-N
XLogP1.11
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.40
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclooctyl-2-[methyl(methylsulfonyl)amino]acetamide?
The IUPAC name of N-cyclooctyl-2-[methyl(methylsulfonyl)amino]acetamide (CID 30464713) is N-cyclooctyl-2-[methyl(methylsulfonyl)amino]acetamide.
What is the SMILES notation for N-cyclooctyl-2-[methyl(methylsulfonyl)amino]acetamide?
The canonical SMILES for N-cyclooctyl-2-[methyl(methylsulfonyl)amino]acetamide is CN(CC(=O)NC1CCCCCCC1)S(C)(=O)=O.
What is the InChIKey of N-cyclooctyl-2-[methyl(methylsulfonyl)amino]acetamide?
The InChIKey is ONVMWUICTAHGMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O3S/c1-14(18(2,16)17)10-12(15)13-11-8-6-4-3-5-7-9-11/h11H,3-10H2,1-2H3,(H,13,15).
What are the key properties of N-cyclooctyl-2-[methyl(methylsulfonyl)amino]acetamide?
N-cyclooctyl-2-[methyl(methylsulfonyl)amino]acetamide has a molecular weight of 276.40 g/mol, XLogP of 1.11, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclooctyl-2-[methyl(methylsulfonyl)amino]acetamide is sourced from PubChem (CID 30464713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).