N-methyl-2-(methylamino)-2-(4-methylsulfonylphenyl)acetamide

C11H16N2O3S — CID 82482633

IUPACN-methyl-2-(methylamino)-2-(4-methylsulfonylphenyl)acetamide
SMILESCNC(=O)C(NC)c1ccc(S(C)(=O)=O)cc1
InChIInChI=1S/C11H16N2O3S/c1-12-10(11(14)13-2)8-4-6-9(7-5-8)17(3,15)16/h4-7,10,12H,1-3H3,(H,13,14)
InChIKeyDQGYOHOURSNBMG-UHFFFAOYSA-N
MW256.33 g/mol
LogP0.10
Rot. Bonds4

About N-methyl-2-(methylamino)-2-(4-methylsulfonylphenyl)acetamide

N-methyl-2-(methylamino)-2-(4-methylsulfonylphenyl)acetamide (PubChem CID 82482633) has the molecular formula C11H16N2O3S and a molecular weight of 256.33 g/mol. Its IUPAC name is N-methyl-2-(methylamino)-2-(4-methylsulfonylphenyl)acetamide.

Molecular Properties

Compound NameN-methyl-2-(methylamino)-2-(4-methylsulfonylphenyl)acetamide
PubChem CID82482633
Molecular FormulaC11H16N2O3S
Molecular Weight256.33 g/mol
Exact Mass256.09
IUPAC NameN-methyl-2-(methylamino)-2-(4-methylsulfonylphenyl)acetamide
SMILESCNC(=O)C(NC)c1ccc(S(C)(=O)=O)cc1
InChIInChI=1S/C11H16N2O3S/c1-12-10(11(14)13-2)8-4-6-9(7-5-8)17(3,15)16/h4-7,10,12H,1-3H3,(H,13,14)
InChIKeyDQGYOHOURSNBMG-UHFFFAOYSA-N
XLogP0.10
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.33
LogP ≤ 50.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-hydroxy-N-methyl-3-[[(1S)-1-(4-methylsulfonylphenyl)ethyl]amino]propanamide
CID 175563500
amino-(4-methylsulfonylphenyl)methanol
CID 116939660
2-hydroxy-N-methyl-3-[[(1S)-1-(4-methylsulfonylphenyl)ethyl]amino]prop-2-enamide
CID 175563523
ethane;(1S)-1-(4-methylsulfonylphenyl)ethanol
CID 143418064
chloro-(4-methylsulfonylphenyl)methanol
CID 172793429
(2R)-2-amino-N-[1-(4-methylsulfonylphenyl)ethyl]propanamide;hydrochloride
CID 119274664
1-bromo-1-(4-methylsulfonylphenyl)propan-2-one
CID 22943544
2-methyl-N-[1-(4-methylsulfonylphenyl)propyl]propanamide
CID 133265262
2-chloro-2-hydroxy-N-[(2R)-2-hydroxy-2-(4-methylsulfonylphenyl)ethyl]acetamide
CID 134298683
2-[[4-(1-aminoethyl)phenyl]sulfonylamino]-N-methylpropanamide
CID 61465790
2-methyl-N-(4-methylsulfonylphenyl)butanamide
CID 51331498
2-methoxy-N-(4-methylsulfonylphenyl)propanamide
CID 47300837

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(methylamino)-2-(4-methylsulfonylphenyl)acetamide?
The IUPAC name of N-methyl-2-(methylamino)-2-(4-methylsulfonylphenyl)acetamide (CID 82482633) is N-methyl-2-(methylamino)-2-(4-methylsulfonylphenyl)acetamide.
What is the SMILES notation for N-methyl-2-(methylamino)-2-(4-methylsulfonylphenyl)acetamide?
The canonical SMILES for N-methyl-2-(methylamino)-2-(4-methylsulfonylphenyl)acetamide is CNC(=O)C(NC)c1ccc(S(C)(=O)=O)cc1.
What is the InChIKey of N-methyl-2-(methylamino)-2-(4-methylsulfonylphenyl)acetamide?
The InChIKey is DQGYOHOURSNBMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O3S/c1-12-10(11(14)13-2)8-4-6-9(7-5-8)17(3,15)16/h4-7,10,12H,1-3H3,(H,13,14).
What are the key properties of N-methyl-2-(methylamino)-2-(4-methylsulfonylphenyl)acetamide?
N-methyl-2-(methylamino)-2-(4-methylsulfonylphenyl)acetamide has a molecular weight of 256.33 g/mol, XLogP of 0.10, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(methylamino)-2-(4-methylsulfonylphenyl)acetamide is sourced from PubChem (CID 82482633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).