5-butan-2-yl-3-(5-methylhexan-2-yl)-2-propylimidazolidin-4-one

C17H34N2O — CID 83263112

IUPAC5-butan-2-yl-3-(5-methylhexan-2-yl)-2-propylimidazolidin-4-one
SMILESCCCC1NC(C(C)CC)C(=O)N1C(C)CCC(C)C
InChIInChI=1S/C17H34N2O/c1-7-9-15-18-16(13(5)8-2)17(20)19(15)14(6)11-10-12(3)4/h12-16,18H,7-11H2,1-6H3
InChIKeyRIQCNDDXICKIBZ-UHFFFAOYSA-N
MW282.47 g/mol
LogP3.78
Rot. Bonds8

About 5-butan-2-yl-3-(5-methylhexan-2-yl)-2-propylimidazolidin-4-one

5-butan-2-yl-3-(5-methylhexan-2-yl)-2-propylimidazolidin-4-one (PubChem CID 83263112) has the molecular formula C17H34N2O and a molecular weight of 282.47 g/mol. Its IUPAC name is 5-butan-2-yl-3-(5-methylhexan-2-yl)-2-propylimidazolidin-4-one.

Molecular Properties

Compound Name5-butan-2-yl-3-(5-methylhexan-2-yl)-2-propylimidazolidin-4-one
PubChem CID83263112
Molecular FormulaC17H34N2O
Molecular Weight282.47 g/mol
Exact Mass282.27
IUPAC Name5-butan-2-yl-3-(5-methylhexan-2-yl)-2-propylimidazolidin-4-one
SMILESCCCC1NC(C(C)CC)C(=O)N1C(C)CCC(C)C
InChIInChI=1S/C17H34N2O/c1-7-9-15-18-16(13(5)8-2)17(20)19(15)14(6)11-10-12(3)4/h12-16,18H,7-11H2,1-6H3
InChIKeyRIQCNDDXICKIBZ-UHFFFAOYSA-N
XLogP3.78
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.47
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-butan-2-yl-3-pentan-3-yl-2-propylimidazolidin-4-one
CID 83241971
5-butan-2-yl-3-(1-ethoxypropan-2-yl)-2-propylimidazolidin-4-one
CID 83247716
5-butan-2-yl-3-(1-methylsulfonylpropan-2-yl)-2-propylimidazolidin-4-one
CID 83262835
5-butan-2-yl-3-(5-methylhexan-2-yl)-2-propan-2-ylimidazolidin-4-one
CID 83264562
5-butan-2-yl-2-ethyl-3-octan-2-ylimidazolidin-4-one
CID 83248188
5-butan-2-yl-3-methyl-2-propylimidazolidin-4-one
CID 83260057
5-butan-2-yl-3-(1-cyclopropylbutan-2-yl)-2-propylimidazolidin-4-one
CID 83263556
5-butan-2-yl-3-(1-methoxy-3-methylbutan-2-yl)-2-propylimidazolidin-4-one
CID 83259061
5-butan-2-yl-2-methyl-3-(6-methylheptan-2-yl)imidazolidin-4-one
CID 83252330
5-butan-2-yl-3-[1-(dimethylamino)propan-2-yl]-2-ethylimidazolidin-4-one
CID 83260616
3-[1-(diethylamino)propan-2-yl]-5-propan-2-yl-2-propylimidazolidin-4-one
CID 83249170
3-pentan-2-yl-2,5-dipropylimidazolidin-4-one
CID 83238815

Frequently Asked Questions

What is the IUPAC name of 5-butan-2-yl-3-(5-methylhexan-2-yl)-2-propylimidazolidin-4-one?
The IUPAC name of 5-butan-2-yl-3-(5-methylhexan-2-yl)-2-propylimidazolidin-4-one (CID 83263112) is 5-butan-2-yl-3-(5-methylhexan-2-yl)-2-propylimidazolidin-4-one.
What is the SMILES notation for 5-butan-2-yl-3-(5-methylhexan-2-yl)-2-propylimidazolidin-4-one?
The canonical SMILES for 5-butan-2-yl-3-(5-methylhexan-2-yl)-2-propylimidazolidin-4-one is CCCC1NC(C(C)CC)C(=O)N1C(C)CCC(C)C.
What is the InChIKey of 5-butan-2-yl-3-(5-methylhexan-2-yl)-2-propylimidazolidin-4-one?
The InChIKey is RIQCNDDXICKIBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O/c1-7-9-15-18-16(13(5)8-2)17(20)19(15)14(6)11-10-12(3)4/h12-16,18H,7-11H2,1-6H3.
What are the key properties of 5-butan-2-yl-3-(5-methylhexan-2-yl)-2-propylimidazolidin-4-one?
5-butan-2-yl-3-(5-methylhexan-2-yl)-2-propylimidazolidin-4-one has a molecular weight of 282.47 g/mol, XLogP of 3.78, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-butan-2-yl-3-(5-methylhexan-2-yl)-2-propylimidazolidin-4-one is sourced from PubChem (CID 83263112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).