2-(ethylamino)-2-methyl-3-(3-methylbutan-2-ylsulfanyl)propanamide

C11H24N2OS — CID 107755689

IUPAC2-(ethylamino)-2-methyl-3-(3-methylbutan-2-ylsulfanyl)propanamide
SMILESCCNC(C)(CSC(C)C(C)C)C(N)=O
InChIInChI=1S/C11H24N2OS/c1-6-13-11(5,10(12)14)7-15-9(4)8(2)3/h8-9,13H,6-7H2,1-5H3,(H2,12,14)
InChIKeyJHKSATJBGNEPFA-UHFFFAOYSA-N
MW232.39 g/mol
LogP1.62
Rot. Bonds7

About 2-(ethylamino)-2-methyl-3-(3-methylbutan-2-ylsulfanyl)propanamide

2-(ethylamino)-2-methyl-3-(3-methylbutan-2-ylsulfanyl)propanamide (PubChem CID 107755689) has the molecular formula C11H24N2OS and a molecular weight of 232.39 g/mol. Its IUPAC name is 2-(ethylamino)-2-methyl-3-(3-methylbutan-2-ylsulfanyl)propanamide.

Molecular Properties

Compound Name2-(ethylamino)-2-methyl-3-(3-methylbutan-2-ylsulfanyl)propanamide
PubChem CID107755689
Molecular FormulaC11H24N2OS
Molecular Weight232.39 g/mol
Exact Mass232.16
IUPAC Name2-(ethylamino)-2-methyl-3-(3-methylbutan-2-ylsulfanyl)propanamide
SMILESCCNC(C)(CSC(C)C(C)C)C(N)=O
InChIInChI=1S/C11H24N2OS/c1-6-13-11(5,10(12)14)7-15-9(4)8(2)3/h8-9,13H,6-7H2,1-5H3,(H2,12,14)
InChIKeyJHKSATJBGNEPFA-UHFFFAOYSA-N
XLogP1.62
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.39
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-2-methyl-3-(3-methylbutan-2-ylsulfanyl)propanamide?
The IUPAC name of 2-(ethylamino)-2-methyl-3-(3-methylbutan-2-ylsulfanyl)propanamide (CID 107755689) is 2-(ethylamino)-2-methyl-3-(3-methylbutan-2-ylsulfanyl)propanamide.
What is the SMILES notation for 2-(ethylamino)-2-methyl-3-(3-methylbutan-2-ylsulfanyl)propanamide?
The canonical SMILES for 2-(ethylamino)-2-methyl-3-(3-methylbutan-2-ylsulfanyl)propanamide is CCNC(C)(CSC(C)C(C)C)C(N)=O.
What is the InChIKey of 2-(ethylamino)-2-methyl-3-(3-methylbutan-2-ylsulfanyl)propanamide?
The InChIKey is JHKSATJBGNEPFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2OS/c1-6-13-11(5,10(12)14)7-15-9(4)8(2)3/h8-9,13H,6-7H2,1-5H3,(H2,12,14).
What are the key properties of 2-(ethylamino)-2-methyl-3-(3-methylbutan-2-ylsulfanyl)propanamide?
2-(ethylamino)-2-methyl-3-(3-methylbutan-2-ylsulfanyl)propanamide has a molecular weight of 232.39 g/mol, XLogP of 1.62, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-2-methyl-3-(3-methylbutan-2-ylsulfanyl)propanamide is sourced from PubChem (CID 107755689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).