5-butan-2-yl-3-[(2-methylcyclopropyl)methyl]-2-propylimidazolidin-4-one

C15H28N2O — CID 113464306

IUPAC5-butan-2-yl-3-[(2-methylcyclopropyl)methyl]-2-propylimidazolidin-4-one
SMILESCCCC1NC(C(C)CC)C(=O)N1CC1CC1C
InChIInChI=1S/C15H28N2O/c1-5-7-13-16-14(10(3)6-2)15(18)17(13)9-12-8-11(12)4/h10-14,16H,5-9H2,1-4H3
InChIKeyUWVZYYFDYREQPO-UHFFFAOYSA-N
MW252.40 g/mol
LogP2.62
Rot. Bonds6

About 5-butan-2-yl-3-[(2-methylcyclopropyl)methyl]-2-propylimidazolidin-4-one

5-butan-2-yl-3-[(2-methylcyclopropyl)methyl]-2-propylimidazolidin-4-one (PubChem CID 113464306) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is 5-butan-2-yl-3-[(2-methylcyclopropyl)methyl]-2-propylimidazolidin-4-one.

Molecular Properties

Compound Name5-butan-2-yl-3-[(2-methylcyclopropyl)methyl]-2-propylimidazolidin-4-one
PubChem CID113464306
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC Name5-butan-2-yl-3-[(2-methylcyclopropyl)methyl]-2-propylimidazolidin-4-one
SMILESCCCC1NC(C(C)CC)C(=O)N1CC1CC1C
InChIInChI=1S/C15H28N2O/c1-5-7-13-16-14(10(3)6-2)15(18)17(13)9-12-8-11(12)4/h10-14,16H,5-9H2,1-4H3
InChIKeyUWVZYYFDYREQPO-UHFFFAOYSA-N
XLogP2.62
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(2-methylcyclohexyl)methyl]-5-propan-2-yl-2-propylimidazolidin-4-one
CID 83256565
5-butan-2-yl-3-[(1,1-dioxothiolan-2-yl)methyl]-2-propylimidazolidin-4-one
CID 83266738
5-butan-2-yl-3-[2-(dimethylamino)ethyl]-2-propylimidazolidin-4-one
CID 83250833
5-butan-2-yl-3-pentan-3-yl-2-propylimidazolidin-4-one
CID 83241971
5-butan-2-yl-3-methyl-2-propylimidazolidin-4-one
CID 83260057
5-butan-2-yl-3-(2-ethylcyclopropyl)-2-propylimidazolidin-4-one
CID 114109870
5-butan-2-yl-3-(2-methoxy-2-methylpropyl)-2-propylimidazolidin-4-one
CID 104767780
5-butan-2-yl-3-(2-ethoxy-2-methylpropyl)-2-propylimidazolidin-4-one
CID 114944867
5-butan-2-yl-3-[2-[methyl(propan-2-yl)amino]ethyl]-2-propylimidazolidin-4-one
CID 83253763
3-[(4-methylcyclohexyl)methyl]-5-propan-2-yl-2-propylimidazolidin-4-one
CID 83254528
5-butan-2-yl-3-(4-methoxybutyl)-2-propylimidazolidin-4-one
CID 83247429
5-butan-2-yl-3-(1-cyclopropylbutan-2-yl)-2-propylimidazolidin-4-one
CID 83263556

Frequently Asked Questions

What is the IUPAC name of 5-butan-2-yl-3-[(2-methylcyclopropyl)methyl]-2-propylimidazolidin-4-one?
The IUPAC name of 5-butan-2-yl-3-[(2-methylcyclopropyl)methyl]-2-propylimidazolidin-4-one (CID 113464306) is 5-butan-2-yl-3-[(2-methylcyclopropyl)methyl]-2-propylimidazolidin-4-one.
What is the SMILES notation for 5-butan-2-yl-3-[(2-methylcyclopropyl)methyl]-2-propylimidazolidin-4-one?
The canonical SMILES for 5-butan-2-yl-3-[(2-methylcyclopropyl)methyl]-2-propylimidazolidin-4-one is CCCC1NC(C(C)CC)C(=O)N1CC1CC1C.
What is the InChIKey of 5-butan-2-yl-3-[(2-methylcyclopropyl)methyl]-2-propylimidazolidin-4-one?
The InChIKey is UWVZYYFDYREQPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-5-7-13-16-14(10(3)6-2)15(18)17(13)9-12-8-11(12)4/h10-14,16H,5-9H2,1-4H3.
What are the key properties of 5-butan-2-yl-3-[(2-methylcyclopropyl)methyl]-2-propylimidazolidin-4-one?
5-butan-2-yl-3-[(2-methylcyclopropyl)methyl]-2-propylimidazolidin-4-one has a molecular weight of 252.40 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 5-butan-2-yl-3-[(2-methylcyclopropyl)methyl]-2-propylimidazolidin-4-one is sourced from PubChem (CID 113464306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).