3-(1-cyclopropylpropan-2-yl)-5-propylimidazolidin-4-one

C12H22N2O — CID 83257228

IUPAC3-(1-cyclopropylpropan-2-yl)-5-propylimidazolidin-4-one
SMILESCCCC1NCN(C(C)CC2CC2)C1=O
InChIInChI=1S/C12H22N2O/c1-3-4-11-12(15)14(8-13-11)9(2)7-10-5-6-10/h9-11,13H,3-8H2,1-2H3
InChIKeyBVWVSFMDIKKCCS-UHFFFAOYSA-N
MW210.32 g/mol
LogP1.73
Rot. Bonds5

About 3-(1-cyclopropylpropan-2-yl)-5-propylimidazolidin-4-one

3-(1-cyclopropylpropan-2-yl)-5-propylimidazolidin-4-one (PubChem CID 83257228) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is 3-(1-cyclopropylpropan-2-yl)-5-propylimidazolidin-4-one.

Molecular Properties

Compound Name3-(1-cyclopropylpropan-2-yl)-5-propylimidazolidin-4-one
PubChem CID83257228
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC Name3-(1-cyclopropylpropan-2-yl)-5-propylimidazolidin-4-one
SMILESCCCC1NCN(C(C)CC2CC2)C1=O
InChIInChI=1S/C12H22N2O/c1-3-4-11-12(15)14(8-13-11)9(2)7-10-5-6-10/h9-11,13H,3-8H2,1-2H3
InChIKeyBVWVSFMDIKKCCS-UHFFFAOYSA-N
XLogP1.73
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(1-cyclopropylpropan-2-yl)-5-propylimidazolidin-4-one?
The IUPAC name of 3-(1-cyclopropylpropan-2-yl)-5-propylimidazolidin-4-one (CID 83257228) is 3-(1-cyclopropylpropan-2-yl)-5-propylimidazolidin-4-one.
What is the SMILES notation for 3-(1-cyclopropylpropan-2-yl)-5-propylimidazolidin-4-one?
The canonical SMILES for 3-(1-cyclopropylpropan-2-yl)-5-propylimidazolidin-4-one is CCCC1NCN(C(C)CC2CC2)C1=O.
What is the InChIKey of 3-(1-cyclopropylpropan-2-yl)-5-propylimidazolidin-4-one?
The InChIKey is BVWVSFMDIKKCCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O/c1-3-4-11-12(15)14(8-13-11)9(2)7-10-5-6-10/h9-11,13H,3-8H2,1-2H3.
What are the key properties of 3-(1-cyclopropylpropan-2-yl)-5-propylimidazolidin-4-one?
3-(1-cyclopropylpropan-2-yl)-5-propylimidazolidin-4-one has a molecular weight of 210.32 g/mol, XLogP of 1.73, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-cyclopropylpropan-2-yl)-5-propylimidazolidin-4-one is sourced from PubChem (CID 83257228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).