2-methyl-5-(2-methylpropyl)-3-[(1-methylsulfanylcyclobutyl)methyl]imidazolidin-4-one

C14H26N2OS — CID 114117454

IUPAC2-methyl-5-(2-methylpropyl)-3-[(1-methylsulfanylcyclobutyl)methyl]imidazolidin-4-one
SMILESCSC1(CN2C(=O)C(CC(C)C)NC2C)CCC1
InChIInChI=1S/C14H26N2OS/c1-10(2)8-12-13(17)16(11(3)15-12)9-14(18-4)6-5-7-14/h10-12,15H,5-9H2,1-4H3
InChIKeyWGXWIYIWTSFDLU-UHFFFAOYSA-N
MW270.44 g/mol
LogP2.46
Rot. Bonds5

About 2-methyl-5-(2-methylpropyl)-3-[(1-methylsulfanylcyclobutyl)methyl]imidazolidin-4-one

2-methyl-5-(2-methylpropyl)-3-[(1-methylsulfanylcyclobutyl)methyl]imidazolidin-4-one (PubChem CID 114117454) has the molecular formula C14H26N2OS and a molecular weight of 270.44 g/mol. Its IUPAC name is 2-methyl-5-(2-methylpropyl)-3-[(1-methylsulfanylcyclobutyl)methyl]imidazolidin-4-one.

Molecular Properties

Compound Name2-methyl-5-(2-methylpropyl)-3-[(1-methylsulfanylcyclobutyl)methyl]imidazolidin-4-one
PubChem CID114117454
Molecular FormulaC14H26N2OS
Molecular Weight270.44 g/mol
Exact Mass270.18
IUPAC Name2-methyl-5-(2-methylpropyl)-3-[(1-methylsulfanylcyclobutyl)methyl]imidazolidin-4-one
SMILESCSC1(CN2C(=O)C(CC(C)C)NC2C)CCC1
InChIInChI=1S/C14H26N2OS/c1-10(2)8-12-13(17)16(11(3)15-12)9-14(18-4)6-5-7-14/h10-12,15H,5-9H2,1-4H3
InChIKeyWGXWIYIWTSFDLU-UHFFFAOYSA-N
XLogP2.46
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.44
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-3-[(1-methylsulfanylcyclobutyl)methyl]-5-propylimidazolidin-4-one
CID 114117436
2-methyl-5-(2-methylpropyl)-3-(2-methylsulfanylethyl)imidazolidin-4-one
CID 83257702
3-[(3-methoxyoxolan-3-yl)methyl]-2-methyl-5-(2-methylpropyl)imidazolidin-4-one
CID 104767875
2-methyl-3-(4-methylpentyl)-5-(2-methylpropyl)imidazolidin-4-one
CID 83254538
2-methyl-3-(2-methylbutyl)-5-(2-methylpropyl)imidazolidin-4-one
CID 83252090
5-ethyl-2-methyl-3-[[1-(2-methylpropyl)cyclopentyl]methyl]imidazolidin-4-one
CID 83270482
3-[2-(dimethylamino)ethyl]-2-methyl-5-(2-methylpropyl)imidazolidin-4-one
CID 83251594
3-[(1-methylcyclopentyl)methyl]-2,5-bis(2-methylpropyl)imidazolidin-4-one
CID 83262725
3-(2-methoxy-2-methylpropyl)-2-methyl-5-(2-methylpropyl)imidazolidin-4-one
CID 104767800
2-methyl-3-[2-(3-methylcyclohexyl)ethyl]-5-(2-methylpropyl)imidazolidin-4-one
CID 83264269
3-(3-methoxy-2-methylpropyl)-2-methyl-5-(2-methylpropyl)imidazolidin-4-one
CID 83250020
2-methyl-3-[3-[methyl(propan-2-yl)amino]propyl]-5-(2-methylpropyl)imidazolidin-4-one
CID 106053028

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-(2-methylpropyl)-3-[(1-methylsulfanylcyclobutyl)methyl]imidazolidin-4-one?
The IUPAC name of 2-methyl-5-(2-methylpropyl)-3-[(1-methylsulfanylcyclobutyl)methyl]imidazolidin-4-one (CID 114117454) is 2-methyl-5-(2-methylpropyl)-3-[(1-methylsulfanylcyclobutyl)methyl]imidazolidin-4-one.
What is the SMILES notation for 2-methyl-5-(2-methylpropyl)-3-[(1-methylsulfanylcyclobutyl)methyl]imidazolidin-4-one?
The canonical SMILES for 2-methyl-5-(2-methylpropyl)-3-[(1-methylsulfanylcyclobutyl)methyl]imidazolidin-4-one is CSC1(CN2C(=O)C(CC(C)C)NC2C)CCC1.
What is the InChIKey of 2-methyl-5-(2-methylpropyl)-3-[(1-methylsulfanylcyclobutyl)methyl]imidazolidin-4-one?
The InChIKey is WGXWIYIWTSFDLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2OS/c1-10(2)8-12-13(17)16(11(3)15-12)9-14(18-4)6-5-7-14/h10-12,15H,5-9H2,1-4H3.
What are the key properties of 2-methyl-5-(2-methylpropyl)-3-[(1-methylsulfanylcyclobutyl)methyl]imidazolidin-4-one?
2-methyl-5-(2-methylpropyl)-3-[(1-methylsulfanylcyclobutyl)methyl]imidazolidin-4-one has a molecular weight of 270.44 g/mol, XLogP of 2.46, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-(2-methylpropyl)-3-[(1-methylsulfanylcyclobutyl)methyl]imidazolidin-4-one is sourced from PubChem (CID 114117454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).