2-(ethylamino)-2-methyl-4-(2-methyloxolan-3-yl)sulfanylbutanamide

C12H24N2O2S — CID 107755324

IUPAC2-(ethylamino)-2-methyl-4-(2-methyloxolan-3-yl)sulfanylbutanamide
SMILESCCNC(C)(CCSC1CCOC1C)C(N)=O
InChIInChI=1S/C12H24N2O2S/c1-4-14-12(3,11(13)15)6-8-17-10-5-7-16-9(10)2/h9-10,14H,4-8H2,1-3H3,(H2,13,15)
InChIKeyMDQMZASQKCISAQ-UHFFFAOYSA-N
MW260.40 g/mol
LogP1.14
Rot. Bonds7

About 2-(ethylamino)-2-methyl-4-(2-methyloxolan-3-yl)sulfanylbutanamide

2-(ethylamino)-2-methyl-4-(2-methyloxolan-3-yl)sulfanylbutanamide (PubChem CID 107755324) has the molecular formula C12H24N2O2S and a molecular weight of 260.40 g/mol. Its IUPAC name is 2-(ethylamino)-2-methyl-4-(2-methyloxolan-3-yl)sulfanylbutanamide.

Molecular Properties

Compound Name2-(ethylamino)-2-methyl-4-(2-methyloxolan-3-yl)sulfanylbutanamide
PubChem CID107755324
Molecular FormulaC12H24N2O2S
Molecular Weight260.40 g/mol
Exact Mass260.16
IUPAC Name2-(ethylamino)-2-methyl-4-(2-methyloxolan-3-yl)sulfanylbutanamide
SMILESCCNC(C)(CCSC1CCOC1C)C(N)=O
InChIInChI=1S/C12H24N2O2S/c1-4-14-12(3,11(13)15)6-8-17-10-5-7-16-9(10)2/h9-10,14H,4-8H2,1-3H3,(H2,13,15)
InChIKeyMDQMZASQKCISAQ-UHFFFAOYSA-N
XLogP1.14
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.40
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(ethylamino)-2-methyl-4-(2-methyloxolan-3-yl)sulfanylbutanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-amino-2-methyl-4-(2-methyloxolan-3-yl)sulfanylbutanamide
CID 107755170
2,2-dimethyl-4-(2-methyloxolan-3-yl)sulfanylbutanimidamide
CID 107750203
2-methyl-6-(2-methyloxolan-3-yl)sulfanyl-2-(propan-2-ylamino)hexanamide
CID 107755159
2-(cyclopropylamino)-2-methyl-3-(2-methyloxolan-3-yl)sulfanylpropanamide
CID 107755232
ethyl 2-methyl-2-(methylamino)-6-(2-methyloxolan-3-yl)sulfanylhexanoate
CID 107755296
methyl 2-(ethylamino)-2-methyl-4-(2-methyloxolan-3-yl)sulfanylpentanoate
CID 107755163
3-(2-methyloxolan-3-yl)sulfanylpropanehydrazide
CID 107760881
2-(2-methyloxolan-3-yl)sulfanylethanol
CID 103847375
1-(ethylamino)-2-[2-(2-methyloxolan-3-yl)sulfanylethyl]cyclopentane-1-carboxamide
CID 107755374
3-cyclopentylsulfanyl-2-(ethylamino)-2-methylpropanamide
CID 63115926
3-(2-methyloxolan-3-yl)sulfanylpropan-1-amine
CID 58684021
3-(2-chloroethylsulfanyl)-2-methyloxolane
CID 107746824

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-2-methyl-4-(2-methyloxolan-3-yl)sulfanylbutanamide?
The IUPAC name of 2-(ethylamino)-2-methyl-4-(2-methyloxolan-3-yl)sulfanylbutanamide (CID 107755324) is 2-(ethylamino)-2-methyl-4-(2-methyloxolan-3-yl)sulfanylbutanamide.
What is the SMILES notation for 2-(ethylamino)-2-methyl-4-(2-methyloxolan-3-yl)sulfanylbutanamide?
The canonical SMILES for 2-(ethylamino)-2-methyl-4-(2-methyloxolan-3-yl)sulfanylbutanamide is CCNC(C)(CCSC1CCOC1C)C(N)=O.
What is the InChIKey of 2-(ethylamino)-2-methyl-4-(2-methyloxolan-3-yl)sulfanylbutanamide?
The InChIKey is MDQMZASQKCISAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2S/c1-4-14-12(3,11(13)15)6-8-17-10-5-7-16-9(10)2/h9-10,14H,4-8H2,1-3H3,(H2,13,15).
What are the key properties of 2-(ethylamino)-2-methyl-4-(2-methyloxolan-3-yl)sulfanylbutanamide?
2-(ethylamino)-2-methyl-4-(2-methyloxolan-3-yl)sulfanylbutanamide has a molecular weight of 260.40 g/mol, XLogP of 1.14, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-2-methyl-4-(2-methyloxolan-3-yl)sulfanylbutanamide is sourced from PubChem (CID 107755324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).