2-(methylamino)-4-methylsulfanylbutanamide

C6H14N2OS — CID 23563340

IUPAC2-(methylamino)-4-methylsulfanylbutanamide
SMILESCNC(CCSC)C(N)=O
InChIInChI=1S/C6H14N2OS/c1-8-5(6(7)9)3-4-10-2/h5,8H,3-4H2,1-2H3,(H2,7,9)
InChIKeyJBYSNNKPWGZSDM-UHFFFAOYSA-N
MW162.26 g/mol
LogP-0.19
Rot. Bonds5

About 2-(methylamino)-4-methylsulfanylbutanamide

2-(methylamino)-4-methylsulfanylbutanamide (PubChem CID 23563340) has the molecular formula C6H14N2OS and a molecular weight of 162.26 g/mol. Its IUPAC name is 2-(methylamino)-4-methylsulfanylbutanamide.

Molecular Properties

Compound Name2-(methylamino)-4-methylsulfanylbutanamide
PubChem CID23563340
Molecular FormulaC6H14N2OS
Molecular Weight162.26 g/mol
Exact Mass162.08
IUPAC Name2-(methylamino)-4-methylsulfanylbutanamide
SMILESCNC(CCSC)C(N)=O
InChIInChI=1S/C6H14N2OS/c1-8-5(6(7)9)3-4-10-2/h5,8H,3-4H2,1-2H3,(H2,7,9)
InChIKeyJBYSNNKPWGZSDM-UHFFFAOYSA-N
XLogP-0.19
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.26
LogP ≤ 5-0.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

L-Methioninamide
CID 146480
(2S)-2-amino-4-(methylsulfanyl)butanamide hydrochloride
CID 18531008
N-Acetyl-DL-methioninamide
CID 536763
d-Methioninamide
CID 11571827
(2S)-2-formamido-4-methylsulfanylbutanamide
CID 56844223
Cyclo-methionylglycine
CID 194124
2-amino-N-methyl-4-(methylsulfanyl)butanamide
CID 10034922
(S)-2-Acetamido-4-(methylthio)butanamide
CID 7004900
2-acetamido-N,N-dimethyl-4-(methylsulfanyl)butanamide
CID 5245532
2-amino-N-methyl-4-(methylsulfanyl)butanamide hydrochloride
CID 20545820
(2S)-2-amino-N-methyl-4-(methylsulfanyl)butanamide hydrochloride
CID 22815139
(2S)-2-amino-N,N-dimethyl-4-(methylsulfanyl)butanamide hydrochloride
CID 119031459

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-4-methylsulfanylbutanamide?
The IUPAC name of 2-(methylamino)-4-methylsulfanylbutanamide (CID 23563340) is 2-(methylamino)-4-methylsulfanylbutanamide.
What is the SMILES notation for 2-(methylamino)-4-methylsulfanylbutanamide?
The canonical SMILES for 2-(methylamino)-4-methylsulfanylbutanamide is CNC(CCSC)C(N)=O.
What is the InChIKey of 2-(methylamino)-4-methylsulfanylbutanamide?
The InChIKey is JBYSNNKPWGZSDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2OS/c1-8-5(6(7)9)3-4-10-2/h5,8H,3-4H2,1-2H3,(H2,7,9).
What are the key properties of 2-(methylamino)-4-methylsulfanylbutanamide?
2-(methylamino)-4-methylsulfanylbutanamide has a molecular weight of 162.26 g/mol, XLogP of -0.19, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-4-methylsulfanylbutanamide is sourced from PubChem (CID 23563340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).