N-cyclohexyl-2-(1-methylsulfonylpropan-2-ylamino)acetamide

C12H24N2O3S — CID 64643777

IUPACN-cyclohexyl-2-(1-methylsulfonylpropan-2-ylamino)acetamide
SMILESCC(CS(C)(=O)=O)NCC(=O)NC1CCCCC1
InChIInChI=1S/C12H24N2O3S/c1-10(9-18(2,16)17)13-8-12(15)14-11-6-4-3-5-7-11/h10-11,13H,3-9H2,1-2H3,(H,14,15)
InChIKeyNJFJDRYSNBBCSS-UHFFFAOYSA-N
MW276.40 g/mol
LogP0.46
Rot. Bonds6

About N-cyclohexyl-2-(1-methylsulfonylpropan-2-ylamino)acetamide

N-cyclohexyl-2-(1-methylsulfonylpropan-2-ylamino)acetamide (PubChem CID 64643777) has the molecular formula C12H24N2O3S and a molecular weight of 276.40 g/mol. Its IUPAC name is N-cyclohexyl-2-(1-methylsulfonylpropan-2-ylamino)acetamide.

Molecular Properties

Compound NameN-cyclohexyl-2-(1-methylsulfonylpropan-2-ylamino)acetamide
PubChem CID64643777
Molecular FormulaC12H24N2O3S
Molecular Weight276.40 g/mol
Exact Mass276.15
IUPAC NameN-cyclohexyl-2-(1-methylsulfonylpropan-2-ylamino)acetamide
SMILESCC(CS(C)(=O)=O)NCC(=O)NC1CCCCC1
InChIInChI=1S/C12H24N2O3S/c1-10(9-18(2,16)17)13-8-12(15)14-11-6-4-3-5-7-11/h10-11,13H,3-9H2,1-2H3,(H,14,15)
InChIKeyNJFJDRYSNBBCSS-UHFFFAOYSA-N
XLogP0.46
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.40
LogP ≤ 50.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cycloheptyl-2-(1-hydroxypropan-2-ylamino)acetamide
CID 62573821
(2R)-2-[[2-(cyclohexylamino)-2-oxoethyl]amino]propanoic acid
CID 83194051
N-cyclohexyl-2-[1-(dimethylamino)propan-2-ylamino]acetamide
CID 82938571
N-cyclopentyl-2-(4-hydroxybutan-2-ylamino)acetamide
CID 83177425
2-[[2-(cyclopentylamino)-2-oxoethyl]amino]-N-cyclopropylpropanamide
CID 113248238
methyl 2-[[2-(cyclohexylamino)-2-oxoethyl]amino]propanoate
CID 60691118
N-cyclopropyl-4-(1-methylsulfonylpropan-2-ylamino)butanamide
CID 79394021
N-cyclopentyl-2-(1-pyrrolidin-1-ylpropan-2-ylamino)acetamide
CID 54952745
N-cyclohexyl-2-[1-(oxan-4-yl)ethylamino]acetamide
CID 103902052
2-(but-3-yn-2-ylamino)-N-cyclohexylacetamide
CID 114416819
2-[[2-(cyclohexylamino)-2-oxoethyl]amino]-3-methylbutanoic acid
CID 43468322
N-[(1S)-1-cyclopentylethyl]-1-methylsulfonylpropan-2-amine
CID 81385766

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(1-methylsulfonylpropan-2-ylamino)acetamide?
The IUPAC name of N-cyclohexyl-2-(1-methylsulfonylpropan-2-ylamino)acetamide (CID 64643777) is N-cyclohexyl-2-(1-methylsulfonylpropan-2-ylamino)acetamide.
What is the SMILES notation for N-cyclohexyl-2-(1-methylsulfonylpropan-2-ylamino)acetamide?
The canonical SMILES for N-cyclohexyl-2-(1-methylsulfonylpropan-2-ylamino)acetamide is CC(CS(C)(=O)=O)NCC(=O)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-(1-methylsulfonylpropan-2-ylamino)acetamide?
The InChIKey is NJFJDRYSNBBCSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O3S/c1-10(9-18(2,16)17)13-8-12(15)14-11-6-4-3-5-7-11/h10-11,13H,3-9H2,1-2H3,(H,14,15).
What are the key properties of N-cyclohexyl-2-(1-methylsulfonylpropan-2-ylamino)acetamide?
N-cyclohexyl-2-(1-methylsulfonylpropan-2-ylamino)acetamide has a molecular weight of 276.40 g/mol, XLogP of 0.46, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(1-methylsulfonylpropan-2-ylamino)acetamide is sourced from PubChem (CID 64643777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).