3-[4-(dimethylamino)butan-2-yl]-5-ethylimidazolidin-4-one

C11H23N3O — CID 83248683

IUPAC3-[4-(dimethylamino)butan-2-yl]-5-ethylimidazolidin-4-one
SMILESCCC1NCN(C(C)CCN(C)C)C1=O
InChIInChI=1S/C11H23N3O/c1-5-10-11(15)14(8-12-10)9(2)6-7-13(3)4/h9-10,12H,5-8H2,1-4H3
InChIKeyKEQSTMJDBXEUNI-UHFFFAOYSA-N
MW213.32 g/mol
LogP0.49
Rot. Bonds5

About 3-[4-(dimethylamino)butan-2-yl]-5-ethylimidazolidin-4-one

3-[4-(dimethylamino)butan-2-yl]-5-ethylimidazolidin-4-one (PubChem CID 83248683) has the molecular formula C11H23N3O and a molecular weight of 213.32 g/mol. Its IUPAC name is 3-[4-(dimethylamino)butan-2-yl]-5-ethylimidazolidin-4-one.

Molecular Properties

Compound Name3-[4-(dimethylamino)butan-2-yl]-5-ethylimidazolidin-4-one
PubChem CID83248683
Molecular FormulaC11H23N3O
Molecular Weight213.32 g/mol
Exact Mass213.18
IUPAC Name3-[4-(dimethylamino)butan-2-yl]-5-ethylimidazolidin-4-one
SMILESCCC1NCN(C(C)CCN(C)C)C1=O
InChIInChI=1S/C11H23N3O/c1-5-10-11(15)14(8-12-10)9(2)6-7-13(3)4/h9-10,12H,5-8H2,1-4H3
InChIKeyKEQSTMJDBXEUNI-UHFFFAOYSA-N
XLogP0.49
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 50.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-heptan-2-yl-5-propylimidazolidin-4-one
CID 83253979
3-[2-(dimethylamino)ethyl]-5-ethylimidazolidin-4-one
CID 83251000
3-heptan-2-yl-5-(2-methylpropyl)imidazolidin-4-one
CID 83254098
5-(2-methylpropyl)-3-octan-2-ylimidazolidin-4-one
CID 83246616
3-[4-(dimethylamino)butan-2-yl]-2-methylimidazolidin-4-one
CID 83249108
3-[2-[di(propan-2-yl)amino]ethyl]-5-ethylimidazolidin-4-one
CID 83237576
5-benzyl-3-hexan-2-ylimidazolidin-4-one
CID 83254120
5-butyl-3-[1-(diethylamino)propan-2-yl]imidazolidin-4-one
CID 83250007
3-(1-cyclopropylpropan-2-yl)-5-propylimidazolidin-4-one
CID 83257228
3-(1-cyclopropylpropan-2-yl)-5-(2-methylpropyl)imidazolidin-4-one
CID 83257317
3-heptan-2-yl-5-propan-2-ylimidazolidin-4-one
CID 83252650
5-ethyl-3-(3-methyl-2-propan-2-ylbutyl)imidazolidin-4-one
CID 102916025

Frequently Asked Questions

What is the IUPAC name of 3-[4-(dimethylamino)butan-2-yl]-5-ethylimidazolidin-4-one?
The IUPAC name of 3-[4-(dimethylamino)butan-2-yl]-5-ethylimidazolidin-4-one (CID 83248683) is 3-[4-(dimethylamino)butan-2-yl]-5-ethylimidazolidin-4-one.
What is the SMILES notation for 3-[4-(dimethylamino)butan-2-yl]-5-ethylimidazolidin-4-one?
The canonical SMILES for 3-[4-(dimethylamino)butan-2-yl]-5-ethylimidazolidin-4-one is CCC1NCN(C(C)CCN(C)C)C1=O.
What is the InChIKey of 3-[4-(dimethylamino)butan-2-yl]-5-ethylimidazolidin-4-one?
The InChIKey is KEQSTMJDBXEUNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O/c1-5-10-11(15)14(8-12-10)9(2)6-7-13(3)4/h9-10,12H,5-8H2,1-4H3.
What are the key properties of 3-[4-(dimethylamino)butan-2-yl]-5-ethylimidazolidin-4-one?
3-[4-(dimethylamino)butan-2-yl]-5-ethylimidazolidin-4-one has a molecular weight of 213.32 g/mol, XLogP of 0.49, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(dimethylamino)butan-2-yl]-5-ethylimidazolidin-4-one is sourced from PubChem (CID 83248683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).