2-[cyclohexyl(methylsulfonyl)amino]acetamide

C9H18N2O3S — CID 963783

IUPAC2-[cyclohexyl(methylsulfonyl)amino]acetamide
SMILESCS(=O)(=O)N(CC(N)=O)C1CCCCC1
InChIInChI=1S/C9H18N2O3S/c1-15(13,14)11(7-9(10)12)8-5-3-2-4-6-8/h8H,2-7H2,1H3,(H2,10,12)
InChIKeyQDBVGTMWMXUNPQ-UHFFFAOYSA-N
MW234.32 g/mol
LogP0.07
Rot. Bonds4

About 2-[cyclohexyl(methylsulfonyl)amino]acetamide

2-[cyclohexyl(methylsulfonyl)amino]acetamide (PubChem CID 963783) has the molecular formula C9H18N2O3S and a molecular weight of 234.32 g/mol. Its IUPAC name is 2-[cyclohexyl(methylsulfonyl)amino]acetamide.

Molecular Properties

Compound Name2-[cyclohexyl(methylsulfonyl)amino]acetamide
PubChem CID963783
Molecular FormulaC9H18N2O3S
Molecular Weight234.32 g/mol
Exact Mass234.10
IUPAC Name2-[cyclohexyl(methylsulfonyl)amino]acetamide
SMILESCS(=O)(=O)N(CC(N)=O)C1CCCCC1
InChIInChI=1S/C9H18N2O3S/c1-15(13,14)11(7-9(10)12)8-5-3-2-4-6-8/h8H,2-7H2,1H3,(H2,10,12)
InChIKeyQDBVGTMWMXUNPQ-UHFFFAOYSA-N
XLogP0.07
TPSA80.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.32
LogP ≤ 50.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[cyclohexyl(methylsulfonyl)amino]acetamide?
The IUPAC name of 2-[cyclohexyl(methylsulfonyl)amino]acetamide (CID 963783) is 2-[cyclohexyl(methylsulfonyl)amino]acetamide.
What is the SMILES notation for 2-[cyclohexyl(methylsulfonyl)amino]acetamide?
The canonical SMILES for 2-[cyclohexyl(methylsulfonyl)amino]acetamide is CS(=O)(=O)N(CC(N)=O)C1CCCCC1.
What is the InChIKey of 2-[cyclohexyl(methylsulfonyl)amino]acetamide?
The InChIKey is QDBVGTMWMXUNPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O3S/c1-15(13,14)11(7-9(10)12)8-5-3-2-4-6-8/h8H,2-7H2,1H3,(H2,10,12).
What are the key properties of 2-[cyclohexyl(methylsulfonyl)amino]acetamide?
2-[cyclohexyl(methylsulfonyl)amino]acetamide has a molecular weight of 234.32 g/mol, XLogP of 0.07, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclohexyl(methylsulfonyl)amino]acetamide is sourced from PubChem (CID 963783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).