5-(2-methylpropyl)-3-(2-methylsulfanylethyl)imidazolidin-4-one

C10H20N2OS — CID 83257953

IUPAC5-(2-methylpropyl)-3-(2-methylsulfanylethyl)imidazolidin-4-one
SMILESCSCCN1CNC(CC(C)C)C1=O
InChIInChI=1S/C10H20N2OS/c1-8(2)6-9-10(13)12(7-11-9)4-5-14-3/h8-9,11H,4-7H2,1-3H3
InChIKeyVXFTXJRTDWTFMX-UHFFFAOYSA-N
MW216.35 g/mol
LogP1.15
Rot. Bonds5

About 5-(2-methylpropyl)-3-(2-methylsulfanylethyl)imidazolidin-4-one

5-(2-methylpropyl)-3-(2-methylsulfanylethyl)imidazolidin-4-one (PubChem CID 83257953) has the molecular formula C10H20N2OS and a molecular weight of 216.35 g/mol. Its IUPAC name is 5-(2-methylpropyl)-3-(2-methylsulfanylethyl)imidazolidin-4-one.

Molecular Properties

Compound Name5-(2-methylpropyl)-3-(2-methylsulfanylethyl)imidazolidin-4-one
PubChem CID83257953
Molecular FormulaC10H20N2OS
Molecular Weight216.35 g/mol
Exact Mass216.13
IUPAC Name5-(2-methylpropyl)-3-(2-methylsulfanylethyl)imidazolidin-4-one
SMILESCSCCN1CNC(CC(C)C)C1=O
InChIInChI=1S/C10H20N2OS/c1-8(2)6-9-10(13)12(7-11-9)4-5-14-3/h8-9,11H,4-7H2,1-3H3
InChIKeyVXFTXJRTDWTFMX-UHFFFAOYSA-N
XLogP1.15
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.35
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(3-methylbutyl)-5-(2-methylpropyl)imidazolidin-4-one
CID 83238290
3-(2-methyl-3-methylsulfanylpropyl)-5-(2-methylpropyl)imidazolidin-4-one
CID 83257472
5-(2-methylpropyl)-3-(2-pyrrolidin-1-ylethyl)imidazolidin-4-one
CID 83253267
5-(2-methylpropyl)-3-[(2,2,3,3-tetramethylcyclopropyl)methyl]imidazolidin-4-one
CID 83258955
3-(2-methoxy-2-methylpropyl)-5-(2-methylpropyl)imidazolidin-4-one
CID 104767754
3-[2-(dimethylamino)-2-methylpropyl]-5-(2-methylpropyl)imidazolidin-4-one
CID 83253023
5-(2-methylpropyl)-3-pentan-3-ylimidazolidin-4-one
CID 83242760
2-methyl-5-(2-methylpropyl)-3-(2-methylsulfanylethyl)imidazolidin-4-one
CID 83257702
3-(2-methylpropyl)-1-(3-methylsulfanylpropyl)-1,4-diazepane-2,5-dione
CID 64972022
3-[(1,1-dioxothiolan-2-yl)methyl]-5-(2-methylpropyl)imidazolidin-4-one
CID 83270602
3-(2,2-dimethylheptyl)-5-(2-methylpropyl)imidazolidin-4-one
CID 83270786
3-(4-methoxy-2,2-dimethylbutyl)-5-(2-methylpropyl)imidazolidin-4-one
CID 114125253

Frequently Asked Questions

What is the IUPAC name of 5-(2-methylpropyl)-3-(2-methylsulfanylethyl)imidazolidin-4-one?
The IUPAC name of 5-(2-methylpropyl)-3-(2-methylsulfanylethyl)imidazolidin-4-one (CID 83257953) is 5-(2-methylpropyl)-3-(2-methylsulfanylethyl)imidazolidin-4-one.
What is the SMILES notation for 5-(2-methylpropyl)-3-(2-methylsulfanylethyl)imidazolidin-4-one?
The canonical SMILES for 5-(2-methylpropyl)-3-(2-methylsulfanylethyl)imidazolidin-4-one is CSCCN1CNC(CC(C)C)C1=O.
What is the InChIKey of 5-(2-methylpropyl)-3-(2-methylsulfanylethyl)imidazolidin-4-one?
The InChIKey is VXFTXJRTDWTFMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2OS/c1-8(2)6-9-10(13)12(7-11-9)4-5-14-3/h8-9,11H,4-7H2,1-3H3.
What are the key properties of 5-(2-methylpropyl)-3-(2-methylsulfanylethyl)imidazolidin-4-one?
5-(2-methylpropyl)-3-(2-methylsulfanylethyl)imidazolidin-4-one has a molecular weight of 216.35 g/mol, XLogP of 1.15, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methylpropyl)-3-(2-methylsulfanylethyl)imidazolidin-4-one is sourced from PubChem (CID 83257953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).