4-(2,5-dimethylphenyl)-3-methyl-1-[2-(methylamino)ethyl]imidazolidin-2-one

C15H23N3O — CID 116981231

IUPAC4-(2,5-dimethylphenyl)-3-methyl-1-[2-(methylamino)ethyl]imidazolidin-2-one
SMILESCNCCN1CC(c2cc(C)ccc2C)N(C)C1=O
InChIInChI=1S/C15H23N3O/c1-11-5-6-12(2)13(9-11)14-10-18(8-7-16-3)15(19)17(14)4/h5-6,9,14,16H,7-8,10H2,1-4H3
InChIKeyBGIBLHOGMVRMHZ-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.93
Rot. Bonds4

About 4-(2,5-dimethylphenyl)-3-methyl-1-[2-(methylamino)ethyl]imidazolidin-2-one

4-(2,5-dimethylphenyl)-3-methyl-1-[2-(methylamino)ethyl]imidazolidin-2-one (PubChem CID 116981231) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 4-(2,5-dimethylphenyl)-3-methyl-1-[2-(methylamino)ethyl]imidazolidin-2-one.

Molecular Properties

Compound Name4-(2,5-dimethylphenyl)-3-methyl-1-[2-(methylamino)ethyl]imidazolidin-2-one
PubChem CID116981231
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name4-(2,5-dimethylphenyl)-3-methyl-1-[2-(methylamino)ethyl]imidazolidin-2-one
SMILESCNCCN1CC(c2cc(C)ccc2C)N(C)C1=O
InChIInChI=1S/C15H23N3O/c1-11-5-6-12(2)13(9-11)14-10-18(8-7-16-3)15(19)17(14)4/h5-6,9,14,16H,7-8,10H2,1-4H3
InChIKeyBGIBLHOGMVRMHZ-UHFFFAOYSA-N
XLogP1.93
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(2,5-dimethylphenyl)-3-methyl-1-[2-(methylamino)ethyl]imidazolidin-2-one?
The IUPAC name of 4-(2,5-dimethylphenyl)-3-methyl-1-[2-(methylamino)ethyl]imidazolidin-2-one (CID 116981231) is 4-(2,5-dimethylphenyl)-3-methyl-1-[2-(methylamino)ethyl]imidazolidin-2-one.
What is the SMILES notation for 4-(2,5-dimethylphenyl)-3-methyl-1-[2-(methylamino)ethyl]imidazolidin-2-one?
The canonical SMILES for 4-(2,5-dimethylphenyl)-3-methyl-1-[2-(methylamino)ethyl]imidazolidin-2-one is CNCCN1CC(c2cc(C)ccc2C)N(C)C1=O.
What is the InChIKey of 4-(2,5-dimethylphenyl)-3-methyl-1-[2-(methylamino)ethyl]imidazolidin-2-one?
The InChIKey is BGIBLHOGMVRMHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-11-5-6-12(2)13(9-11)14-10-18(8-7-16-3)15(19)17(14)4/h5-6,9,14,16H,7-8,10H2,1-4H3.
What are the key properties of 4-(2,5-dimethylphenyl)-3-methyl-1-[2-(methylamino)ethyl]imidazolidin-2-one?
4-(2,5-dimethylphenyl)-3-methyl-1-[2-(methylamino)ethyl]imidazolidin-2-one has a molecular weight of 261.37 g/mol, XLogP of 1.93, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,5-dimethylphenyl)-3-methyl-1-[2-(methylamino)ethyl]imidazolidin-2-one is sourced from PubChem (CID 116981231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).