N-[(2S)-1-methoxypropan-2-yl]-2-[methyl(methylsulfonyl)amino]acetamide

C8H18N2O4S — CID 30464721

IUPACN-[(2S)-1-methoxypropan-2-yl]-2-[methyl(methylsulfonyl)amino]acetamide
SMILESCOC[C@H](C)NC(=O)CN(C)S(C)(=O)=O
InChIInChI=1S/C8H18N2O4S/c1-7(6-14-3)9-8(11)5-10(2)15(4,12)13/h7H,5-6H2,1-4H3,(H,9,11)/t7-/m0/s1
InChIKeyXSNPNDHZCWFHMH-ZETCQYMHSA-N
MW238.31 g/mol
LogP-0.97
Rot. Bonds6

About N-[(2S)-1-methoxypropan-2-yl]-2-[methyl(methylsulfonyl)amino]acetamide

N-[(2S)-1-methoxypropan-2-yl]-2-[methyl(methylsulfonyl)amino]acetamide (PubChem CID 30464721) has the molecular formula C8H18N2O4S and a molecular weight of 238.31 g/mol. Its IUPAC name is N-[(2S)-1-methoxypropan-2-yl]-2-[methyl(methylsulfonyl)amino]acetamide.

Molecular Properties

Compound NameN-[(2S)-1-methoxypropan-2-yl]-2-[methyl(methylsulfonyl)amino]acetamide
PubChem CID30464721
Molecular FormulaC8H18N2O4S
Molecular Weight238.31 g/mol
Exact Mass238.10
IUPAC NameN-[(2S)-1-methoxypropan-2-yl]-2-[methyl(methylsulfonyl)amino]acetamide
SMILESCOC[C@H](C)NC(=O)CN(C)S(C)(=O)=O
InChIInChI=1S/C8H18N2O4S/c1-7(6-14-3)9-8(11)5-10(2)15(4,12)13/h7H,5-6H2,1-4H3,(H,9,11)/t7-/m0/s1
InChIKeyXSNPNDHZCWFHMH-ZETCQYMHSA-N
XLogP-0.97
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.31
LogP ≤ 5-0.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(N-methylmethylsulfonamido)-N-(4-morpholinobut-2-yn-1-yl)acetamide
CID 71792713
2-[3-(methanesulfonamido)piperidin-1-yl]-N-(2-methoxyethyl)acetamide
CID 53509564
2-[(2R*,6S*)-2,6-dimethylmorpholin-4-yl]-N-{2-[methyl(methylsulfonyl)amino]ethyl}propanamide
CID 56867283
2-[methyl(methylsulfonyl)amino]-N-propan-2-ylacetamide
CID 30464337
N-[(2S)-butan-2-yl]-2-[methyl(methylsulfonyl)amino]acetamide
CID 30464345
2-[methylsulfonyl(propan-2-yl)amino]-N-propan-2-ylacetamide
CID 59304320
2-[ethyl(methylsulfonyl)amino]-N-propan-2-ylacetamide
CID 60681329
N-ethyl-2-[methylsulfonyl(propan-2-yl)amino]acetamide
CID 88934420
N-butan-2-yl-2-[methylsulfonyl(propan-2-yl)amino]acetamide
CID 89324211
2-[Bis[2-(methylamino)-2-oxoethyl]amino]ethyl methanesulfonate
CID 89771710
Methyl 2-acetamido-3-(methanesulfonamido)propanoate
CID 123707802
N-methyl-N-[3-[2-(propan-2-ylamino)ethoxy]propylsulfonyl]acetamide
CID 166800634

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-1-methoxypropan-2-yl]-2-[methyl(methylsulfonyl)amino]acetamide?
The IUPAC name of N-[(2S)-1-methoxypropan-2-yl]-2-[methyl(methylsulfonyl)amino]acetamide (CID 30464721) is N-[(2S)-1-methoxypropan-2-yl]-2-[methyl(methylsulfonyl)amino]acetamide.
What is the SMILES notation for N-[(2S)-1-methoxypropan-2-yl]-2-[methyl(methylsulfonyl)amino]acetamide?
The canonical SMILES for N-[(2S)-1-methoxypropan-2-yl]-2-[methyl(methylsulfonyl)amino]acetamide is COC[C@H](C)NC(=O)CN(C)S(C)(=O)=O.
What is the InChIKey of N-[(2S)-1-methoxypropan-2-yl]-2-[methyl(methylsulfonyl)amino]acetamide?
The InChIKey is XSNPNDHZCWFHMH-ZETCQYMHSA-N. The full InChI is InChI=1S/C8H18N2O4S/c1-7(6-14-3)9-8(11)5-10(2)15(4,12)13/h7H,5-6H2,1-4H3,(H,9,11)/t7-/m0/s1.
What are the key properties of N-[(2S)-1-methoxypropan-2-yl]-2-[methyl(methylsulfonyl)amino]acetamide?
N-[(2S)-1-methoxypropan-2-yl]-2-[methyl(methylsulfonyl)amino]acetamide has a molecular weight of 238.31 g/mol, XLogP of -0.97, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-1-methoxypropan-2-yl]-2-[methyl(methylsulfonyl)amino]acetamide is sourced from PubChem (CID 30464721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).