2,5-diethyl-3-hexan-3-yl-5-methylimidazolidin-4-one

C14H28N2O — CID 83252694

IUPAC2,5-diethyl-3-hexan-3-yl-5-methylimidazolidin-4-one
SMILESCCCC(CC)N1C(=O)C(C)(CC)NC1CC
InChIInChI=1S/C14H28N2O/c1-6-10-11(7-2)16-12(8-3)15-14(5,9-4)13(16)17/h11-12,15H,6-10H2,1-5H3
InChIKeyKLDHNQSOPYFVHJ-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.90
Rot. Bonds6

About 2,5-diethyl-3-hexan-3-yl-5-methylimidazolidin-4-one

2,5-diethyl-3-hexan-3-yl-5-methylimidazolidin-4-one (PubChem CID 83252694) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 2,5-diethyl-3-hexan-3-yl-5-methylimidazolidin-4-one.

Molecular Properties

Compound Name2,5-diethyl-3-hexan-3-yl-5-methylimidazolidin-4-one
PubChem CID83252694
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name2,5-diethyl-3-hexan-3-yl-5-methylimidazolidin-4-one
SMILESCCCC(CC)N1C(=O)C(C)(CC)NC1CC
InChIInChI=1S/C14H28N2O/c1-6-10-11(7-2)16-12(8-3)15-14(5,9-4)13(16)17/h11-12,15H,6-10H2,1-5H3
InChIKeyKLDHNQSOPYFVHJ-UHFFFAOYSA-N
XLogP2.90
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 ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethyl-3-hexan-3-ylimidazolidin-4-one
CID 83252525
3-[1-(dimethylamino)-3-methylbutan-2-yl]-2,5-diethyl-5-methylimidazolidin-4-one
CID 83249274
2,5-diethyl-5-methyl-3-octylimidazolidin-4-one
CID 83260188
3-(2,2-dimethylpropyl)-2,5-diethyl-5-methylimidazolidin-4-one
CID 83255826
3,3-diethyl-1-hexan-3-yl-6-propan-2-ylpiperazine-2,5-dione
CID 64968418
3-[2-(dimethylamino)propyl]-2,5-diethyl-5-methylimidazolidin-4-one
CID 83250197
3-(1-cyclohexylpropyl)-5-ethyl-5-methyl-2-propylimidazolidin-4-one
CID 83249303
2-cyclopentyl-5-ethyl-5-methyl-3-pentan-2-ylimidazolidin-4-one
CID 83239474
3-(2-cyclopropylpropyl)-2,5-diethyl-5-methylimidazolidin-4-one
CID 113476700
2,5-diethyl-5-methyl-3-(2-methylsulfonylethyl)imidazolidin-4-one
CID 83256120
5,5-diethyl-1-hexan-3-yl-1,3-diazinane-2,4,6-trione
CID 112600385
5-ethyl-5-methyl-3-(4-methylpentyl)-2-propylimidazolidin-4-one
CID 83255455

Frequently Asked Questions

What is the IUPAC name of 2,5-diethyl-3-hexan-3-yl-5-methylimidazolidin-4-one?
The IUPAC name of 2,5-diethyl-3-hexan-3-yl-5-methylimidazolidin-4-one (CID 83252694) is 2,5-diethyl-3-hexan-3-yl-5-methylimidazolidin-4-one.
What is the SMILES notation for 2,5-diethyl-3-hexan-3-yl-5-methylimidazolidin-4-one?
The canonical SMILES for 2,5-diethyl-3-hexan-3-yl-5-methylimidazolidin-4-one is CCCC(CC)N1C(=O)C(C)(CC)NC1CC.
What is the InChIKey of 2,5-diethyl-3-hexan-3-yl-5-methylimidazolidin-4-one?
The InChIKey is KLDHNQSOPYFVHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-6-10-11(7-2)16-12(8-3)15-14(5,9-4)13(16)17/h11-12,15H,6-10H2,1-5H3.
What are the key properties of 2,5-diethyl-3-hexan-3-yl-5-methylimidazolidin-4-one?
2,5-diethyl-3-hexan-3-yl-5-methylimidazolidin-4-one has a molecular weight of 240.39 g/mol, XLogP of 2.90, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-diethyl-3-hexan-3-yl-5-methylimidazolidin-4-one is sourced from PubChem (CID 83252694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).