N-methyl-2-methylsulfanylpropanamide

C5H11NOS — CID 55208447

IUPACN-methyl-2-methylsulfanylpropanamide
SMILESCNC(=O)C(C)SC
InChIInChI=1S/C5H11NOS/c1-4(8-3)5(7)6-2/h4H,1-3H3,(H,6,7)
InChIKeyWECOZIBSYPJXKM-UHFFFAOYSA-N
MW133.22 g/mol
LogP0.48
Rot. Bonds2

About N-methyl-2-methylsulfanylpropanamide

N-methyl-2-methylsulfanylpropanamide (PubChem CID 55208447) has the molecular formula C5H11NOS and a molecular weight of 133.22 g/mol. Its IUPAC name is N-methyl-2-methylsulfanylpropanamide.

Molecular Properties

Compound NameN-methyl-2-methylsulfanylpropanamide
PubChem CID55208447
Molecular FormulaC5H11NOS
Molecular Weight133.22 g/mol
Exact Mass133.06
IUPAC NameN-methyl-2-methylsulfanylpropanamide
SMILESCNC(=O)C(C)SC
InChIInChI=1S/C5H11NOS/c1-4(8-3)5(7)6-2/h4H,1-3H3,(H,6,7)
InChIKeyWECOZIBSYPJXKM-UHFFFAOYSA-N
XLogP0.48
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.22
LogP ≤ 50.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-methylsulfanylpropanoylamino)propanoic acid
CID 22950848
2-methyl-N-[2-(2-methylsulfanylpropanoylamino)ethyl]propanamide
CID 71941856
2-methylsulfanyl-N-propylpropanamide
CID 131085433
N-cyclopentyl-2-methylsulfanylpropanamide
CID 126996006
2-methyl-3-(2-methylsulfanylpropanoylamino)propanoic acid
CID 115731422
2-methylsulfanylpropanethioic S-acid
CID 150375573
(2R)-2-chloro-N-methylpropanamide
CID 7130812
N-methyl-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]propanamide
CID 75649599
(2S)-4-methyl-2-(2-methylsulfanylpropanoylamino)pentanoic acid
CID 119361586
2,3-dihydroxy-N,N'-dimethylbutanediamide
CID 5168238
potassium 2-methylsulfanylpropanoate
CID 88802261
(2S)-2-methylsulfanyl-N-(3-methylsulfanylphenyl)propanamide
CID 38886217

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-methylsulfanylpropanamide?
The IUPAC name of N-methyl-2-methylsulfanylpropanamide (CID 55208447) is N-methyl-2-methylsulfanylpropanamide.
What is the SMILES notation for N-methyl-2-methylsulfanylpropanamide?
The canonical SMILES for N-methyl-2-methylsulfanylpropanamide is CNC(=O)C(C)SC.
What is the InChIKey of N-methyl-2-methylsulfanylpropanamide?
The InChIKey is WECOZIBSYPJXKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NOS/c1-4(8-3)5(7)6-2/h4H,1-3H3,(H,6,7).
What are the key properties of N-methyl-2-methylsulfanylpropanamide?
N-methyl-2-methylsulfanylpropanamide has a molecular weight of 133.22 g/mol, XLogP of 0.48, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-methylsulfanylpropanamide is sourced from PubChem (CID 55208447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).