2-(2-methylpropyl)-5-propyl-3-(3-pyrrolidin-1-ylpropyl)imidazolidin-4-one

C17H33N3O — CID 83249859

IUPAC2-(2-methylpropyl)-5-propyl-3-(3-pyrrolidin-1-ylpropyl)imidazolidin-4-one
SMILESCCCC1NC(CC(C)C)N(CCCN2CCCC2)C1=O
InChIInChI=1S/C17H33N3O/c1-4-8-15-17(21)20(16(18-15)13-14(2)3)12-7-11-19-9-5-6-10-19/h14-16,18H,4-13H2,1-3H3
InChIKeyPYPMXSPPUKDEHX-UHFFFAOYSA-N
MW295.47 g/mol
LogP2.44
Rot. Bonds8

About 2-(2-methylpropyl)-5-propyl-3-(3-pyrrolidin-1-ylpropyl)imidazolidin-4-one

2-(2-methylpropyl)-5-propyl-3-(3-pyrrolidin-1-ylpropyl)imidazolidin-4-one (PubChem CID 83249859) has the molecular formula C17H33N3O and a molecular weight of 295.47 g/mol. Its IUPAC name is 2-(2-methylpropyl)-5-propyl-3-(3-pyrrolidin-1-ylpropyl)imidazolidin-4-one.

Molecular Properties

Compound Name2-(2-methylpropyl)-5-propyl-3-(3-pyrrolidin-1-ylpropyl)imidazolidin-4-one
PubChem CID83249859
Molecular FormulaC17H33N3O
Molecular Weight295.47 g/mol
Exact Mass295.26
IUPAC Name2-(2-methylpropyl)-5-propyl-3-(3-pyrrolidin-1-ylpropyl)imidazolidin-4-one
SMILESCCCC1NC(CC(C)C)N(CCCN2CCCC2)C1=O
InChIInChI=1S/C17H33N3O/c1-4-8-15-17(21)20(16(18-15)13-14(2)3)12-7-11-19-9-5-6-10-19/h14-16,18H,4-13H2,1-3H3
InChIKeyPYPMXSPPUKDEHX-UHFFFAOYSA-N
XLogP2.44
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.47
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-methylpropyl)-3,5-dipropylimidazolidin-4-one
CID 83242530
5-butyl-2-ethyl-3-(3-pyrrolidin-1-ylpropyl)imidazolidin-4-one
CID 83254451
3-(3-methoxypropyl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one
CID 83243478
3-(2-piperidin-1-ylethyl)-2,5-dipropylimidazolidin-4-one
CID 83244837
5-butyl-3-(2-cyclopentylethyl)-2-(2-methylpropyl)imidazolidin-4-one
CID 83246039
2-(2-methylpropyl)-3-[2-(oxan-2-yl)ethyl]-5-propylimidazolidin-4-one
CID 106000199
5-ethyl-2-(2-methylpropyl)-3-octylimidazolidin-4-one
CID 83260459
3-[[1-(dimethylamino)cyclobutyl]methyl]-2-(2-methylpropyl)-5-propylimidazolidin-4-one
CID 105421083
3-(4-methylpentyl)-2,5-bis(2-methylpropyl)imidazolidin-4-one
CID 83254863
3-pentyl-2,5-dipropylimidazolidin-4-one
CID 83250379
2-ethyl-5-(2-methylpropyl)-3-octylimidazolidin-4-one
CID 83260834
3-[(1,1-dioxothiolan-2-yl)methyl]-2-(2-methylpropyl)-5-propylimidazolidin-4-one
CID 83266748

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylpropyl)-5-propyl-3-(3-pyrrolidin-1-ylpropyl)imidazolidin-4-one?
The IUPAC name of 2-(2-methylpropyl)-5-propyl-3-(3-pyrrolidin-1-ylpropyl)imidazolidin-4-one (CID 83249859) is 2-(2-methylpropyl)-5-propyl-3-(3-pyrrolidin-1-ylpropyl)imidazolidin-4-one.
What is the SMILES notation for 2-(2-methylpropyl)-5-propyl-3-(3-pyrrolidin-1-ylpropyl)imidazolidin-4-one?
The canonical SMILES for 2-(2-methylpropyl)-5-propyl-3-(3-pyrrolidin-1-ylpropyl)imidazolidin-4-one is CCCC1NC(CC(C)C)N(CCCN2CCCC2)C1=O.
What is the InChIKey of 2-(2-methylpropyl)-5-propyl-3-(3-pyrrolidin-1-ylpropyl)imidazolidin-4-one?
The InChIKey is PYPMXSPPUKDEHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33N3O/c1-4-8-15-17(21)20(16(18-15)13-14(2)3)12-7-11-19-9-5-6-10-19/h14-16,18H,4-13H2,1-3H3.
What are the key properties of 2-(2-methylpropyl)-5-propyl-3-(3-pyrrolidin-1-ylpropyl)imidazolidin-4-one?
2-(2-methylpropyl)-5-propyl-3-(3-pyrrolidin-1-ylpropyl)imidazolidin-4-one has a molecular weight of 295.47 g/mol, XLogP of 2.44, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylpropyl)-5-propyl-3-(3-pyrrolidin-1-ylpropyl)imidazolidin-4-one is sourced from PubChem (CID 83249859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).