5-butyl-2-propyl-3-[(2,2,3,3-tetramethylcyclopropyl)methyl]imidazolidin-4-one

C18H34N2O — CID 83269331

IUPAC5-butyl-2-propyl-3-[(2,2,3,3-tetramethylcyclopropyl)methyl]imidazolidin-4-one
SMILESCCCCC1NC(CCC)N(CC2C(C)(C)C2(C)C)C1=O
InChIInChI=1S/C18H34N2O/c1-7-9-11-13-16(21)20(15(19-13)10-8-2)12-14-17(3,4)18(14,5)6/h13-15,19H,7-12H2,1-6H3
InChIKeyZQOLKFYQEKLEPO-UHFFFAOYSA-N
MW294.48 g/mol
LogP3.79
Rot. Bonds7

About 5-butyl-2-propyl-3-[(2,2,3,3-tetramethylcyclopropyl)methyl]imidazolidin-4-one

5-butyl-2-propyl-3-[(2,2,3,3-tetramethylcyclopropyl)methyl]imidazolidin-4-one (PubChem CID 83269331) has the molecular formula C18H34N2O and a molecular weight of 294.48 g/mol. Its IUPAC name is 5-butyl-2-propyl-3-[(2,2,3,3-tetramethylcyclopropyl)methyl]imidazolidin-4-one.

Molecular Properties

Compound Name5-butyl-2-propyl-3-[(2,2,3,3-tetramethylcyclopropyl)methyl]imidazolidin-4-one
PubChem CID83269331
Molecular FormulaC18H34N2O
Molecular Weight294.48 g/mol
Exact Mass294.27
IUPAC Name5-butyl-2-propyl-3-[(2,2,3,3-tetramethylcyclopropyl)methyl]imidazolidin-4-one
SMILESCCCCC1NC(CCC)N(CC2C(C)(C)C2(C)C)C1=O
InChIInChI=1S/C18H34N2O/c1-7-9-11-13-16(21)20(15(19-13)10-8-2)12-14-17(3,4)18(14,5)6/h13-15,19H,7-12H2,1-6H3
InChIKeyZQOLKFYQEKLEPO-UHFFFAOYSA-N
XLogP3.79
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.48
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-pentyl-2,5-dipropylimidazolidin-4-one
CID 83250379
5-butyl-3-(2-methoxy-2-methylpropyl)-2-propylimidazolidin-4-one
CID 104767723
5-butyl-3-(3-methoxypropyl)-2-propylimidazolidin-4-one
CID 83243884
5-butyl-3-[(1-ethylpyrrolidin-2-yl)methyl]-2-propylimidazolidin-4-one
CID 83244979
5-butyl-3-(3-cyclopentylpropyl)-2-propylimidazolidin-4-one
CID 106011295
5-butyl-3-(2-cyclopentyloxyethyl)-2-propylimidazolidin-4-one
CID 83264500
5-butyl-3-(4-propan-2-yloxybutyl)-2-propylimidazolidin-4-one
CID 106011093
5-butyl-3-(3,3-dimethylbutan-2-yl)-2-propylimidazolidin-4-one
CID 104830708
3-(2-methylpropyl)-2,5-dipropylimidazolidin-4-one
CID 83242304
3-[(2-methylcyclopentyl)methyl]-2,5-dipropylimidazolidin-4-one
CID 107421422
5-butyl-3-(2,2-dimethylcyclohexyl)-2-propylimidazolidin-4-one
CID 83269555
5-butyl-3-cyclooctyl-2-propylimidazolidin-4-one
CID 83238137

Frequently Asked Questions

What is the IUPAC name of 5-butyl-2-propyl-3-[(2,2,3,3-tetramethylcyclopropyl)methyl]imidazolidin-4-one?
The IUPAC name of 5-butyl-2-propyl-3-[(2,2,3,3-tetramethylcyclopropyl)methyl]imidazolidin-4-one (CID 83269331) is 5-butyl-2-propyl-3-[(2,2,3,3-tetramethylcyclopropyl)methyl]imidazolidin-4-one.
What is the SMILES notation for 5-butyl-2-propyl-3-[(2,2,3,3-tetramethylcyclopropyl)methyl]imidazolidin-4-one?
The canonical SMILES for 5-butyl-2-propyl-3-[(2,2,3,3-tetramethylcyclopropyl)methyl]imidazolidin-4-one is CCCCC1NC(CCC)N(CC2C(C)(C)C2(C)C)C1=O.
What is the InChIKey of 5-butyl-2-propyl-3-[(2,2,3,3-tetramethylcyclopropyl)methyl]imidazolidin-4-one?
The InChIKey is ZQOLKFYQEKLEPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34N2O/c1-7-9-11-13-16(21)20(15(19-13)10-8-2)12-14-17(3,4)18(14,5)6/h13-15,19H,7-12H2,1-6H3.
What are the key properties of 5-butyl-2-propyl-3-[(2,2,3,3-tetramethylcyclopropyl)methyl]imidazolidin-4-one?
5-butyl-2-propyl-3-[(2,2,3,3-tetramethylcyclopropyl)methyl]imidazolidin-4-one has a molecular weight of 294.48 g/mol, XLogP of 3.79, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-butyl-2-propyl-3-[(2,2,3,3-tetramethylcyclopropyl)methyl]imidazolidin-4-one is sourced from PubChem (CID 83269331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).