2-methyl-3-(4-methylpentyl)-5-(2-methylpropyl)imidazolidin-4-one

C14H28N2O — CID 83254538

IUPAC2-methyl-3-(4-methylpentyl)-5-(2-methylpropyl)imidazolidin-4-one
SMILESCC(C)CCCN1C(=O)C(CC(C)C)NC1C
InChIInChI=1S/C14H28N2O/c1-10(2)7-6-8-16-12(5)15-13(14(16)17)9-11(3)4/h10-13,15H,6-9H2,1-5H3
InChIKeyIVDUCKMJZCSGBG-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.62
Rot. Bonds6

About 2-methyl-3-(4-methylpentyl)-5-(2-methylpropyl)imidazolidin-4-one

2-methyl-3-(4-methylpentyl)-5-(2-methylpropyl)imidazolidin-4-one (PubChem CID 83254538) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 2-methyl-3-(4-methylpentyl)-5-(2-methylpropyl)imidazolidin-4-one.

Molecular Properties

Compound Name2-methyl-3-(4-methylpentyl)-5-(2-methylpropyl)imidazolidin-4-one
PubChem CID83254538
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name2-methyl-3-(4-methylpentyl)-5-(2-methylpropyl)imidazolidin-4-one
SMILESCC(C)CCCN1C(=O)C(CC(C)C)NC1C
InChIInChI=1S/C14H28N2O/c1-10(2)7-6-8-16-12(5)15-13(14(16)17)9-11(3)4/h10-13,15H,6-9H2,1-5H3
InChIKeyIVDUCKMJZCSGBG-UHFFFAOYSA-N
XLogP2.62
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(4-methylpentyl)-5-(2-methylpropyl)imidazolidin-4-one?
The IUPAC name of 2-methyl-3-(4-methylpentyl)-5-(2-methylpropyl)imidazolidin-4-one (CID 83254538) is 2-methyl-3-(4-methylpentyl)-5-(2-methylpropyl)imidazolidin-4-one.
What is the SMILES notation for 2-methyl-3-(4-methylpentyl)-5-(2-methylpropyl)imidazolidin-4-one?
The canonical SMILES for 2-methyl-3-(4-methylpentyl)-5-(2-methylpropyl)imidazolidin-4-one is CC(C)CCCN1C(=O)C(CC(C)C)NC1C.
What is the InChIKey of 2-methyl-3-(4-methylpentyl)-5-(2-methylpropyl)imidazolidin-4-one?
The InChIKey is IVDUCKMJZCSGBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-10(2)7-6-8-16-12(5)15-13(14(16)17)9-11(3)4/h10-13,15H,6-9H2,1-5H3.
What are the key properties of 2-methyl-3-(4-methylpentyl)-5-(2-methylpropyl)imidazolidin-4-one?
2-methyl-3-(4-methylpentyl)-5-(2-methylpropyl)imidazolidin-4-one has a molecular weight of 240.39 g/mol, XLogP of 2.62, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(4-methylpentyl)-5-(2-methylpropyl)imidazolidin-4-one is sourced from PubChem (CID 83254538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).