5-ethyl-5-methyl-2-propyl-3-(2-pyrrolidin-1-ylethyl)imidazolidin-4-one

C15H29N3O — CID 83252241

IUPAC5-ethyl-5-methyl-2-propyl-3-(2-pyrrolidin-1-ylethyl)imidazolidin-4-one
SMILESCCCC1NC(C)(CC)C(=O)N1CCN1CCCC1
InChIInChI=1S/C15H29N3O/c1-4-8-13-16-15(3,5-2)14(19)18(13)12-11-17-9-6-7-10-17/h13,16H,4-12H2,1-3H3
InChIKeyADAQBXPXKKDTPL-UHFFFAOYSA-N
MW267.42 g/mol
LogP1.81
Rot. Bonds6

About 5-ethyl-5-methyl-2-propyl-3-(2-pyrrolidin-1-ylethyl)imidazolidin-4-one

5-ethyl-5-methyl-2-propyl-3-(2-pyrrolidin-1-ylethyl)imidazolidin-4-one (PubChem CID 83252241) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is 5-ethyl-5-methyl-2-propyl-3-(2-pyrrolidin-1-ylethyl)imidazolidin-4-one.

Molecular Properties

Compound Name5-ethyl-5-methyl-2-propyl-3-(2-pyrrolidin-1-ylethyl)imidazolidin-4-one
PubChem CID83252241
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC Name5-ethyl-5-methyl-2-propyl-3-(2-pyrrolidin-1-ylethyl)imidazolidin-4-one
SMILESCCCC1NC(C)(CC)C(=O)N1CCN1CCCC1
InChIInChI=1S/C15H29N3O/c1-4-8-13-16-15(3,5-2)14(19)18(13)12-11-17-9-6-7-10-17/h13,16H,4-12H2,1-3H3
InChIKeyADAQBXPXKKDTPL-UHFFFAOYSA-N
XLogP1.81
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-5-methyl-2-propyl-3-(2-pyrrolidin-1-ylethyl)imidazolidin-4-one?
The IUPAC name of 5-ethyl-5-methyl-2-propyl-3-(2-pyrrolidin-1-ylethyl)imidazolidin-4-one (CID 83252241) is 5-ethyl-5-methyl-2-propyl-3-(2-pyrrolidin-1-ylethyl)imidazolidin-4-one.
What is the SMILES notation for 5-ethyl-5-methyl-2-propyl-3-(2-pyrrolidin-1-ylethyl)imidazolidin-4-one?
The canonical SMILES for 5-ethyl-5-methyl-2-propyl-3-(2-pyrrolidin-1-ylethyl)imidazolidin-4-one is CCCC1NC(C)(CC)C(=O)N1CCN1CCCC1.
What is the InChIKey of 5-ethyl-5-methyl-2-propyl-3-(2-pyrrolidin-1-ylethyl)imidazolidin-4-one?
The InChIKey is ADAQBXPXKKDTPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-4-8-13-16-15(3,5-2)14(19)18(13)12-11-17-9-6-7-10-17/h13,16H,4-12H2,1-3H3.
What are the key properties of 5-ethyl-5-methyl-2-propyl-3-(2-pyrrolidin-1-ylethyl)imidazolidin-4-one?
5-ethyl-5-methyl-2-propyl-3-(2-pyrrolidin-1-ylethyl)imidazolidin-4-one has a molecular weight of 267.42 g/mol, XLogP of 1.81, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-5-methyl-2-propyl-3-(2-pyrrolidin-1-ylethyl)imidazolidin-4-one is sourced from PubChem (CID 83252241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).