1,3-dibutylimidazolidin-2-one

C11H22N2O — CID 20887

IUPAC1,3-dibutylimidazolidin-2-one
SMILESCCCCN1CCN(CCCC)C1=O
InChIInChI=1S/C11H22N2O/c1-3-5-7-12-9-10-13(11(12)14)8-6-4-2/h3-10H2,1-2H3
InChIKeyFXCPLDHPNOXGOM-UHFFFAOYSA-N
MW198.31 g/mol
LogP2.32
Rot. Bonds6

About 1,3-dibutylimidazolidin-2-one

1,3-dibutylimidazolidin-2-one (PubChem CID 20887) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 1,3-dibutylimidazolidin-2-one.

Molecular Properties

Compound Name1,3-dibutylimidazolidin-2-one
PubChem CID20887
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name1,3-dibutylimidazolidin-2-one
SMILESCCCCN1CCN(CCCC)C1=O
InChIInChI=1S/C11H22N2O/c1-3-5-7-12-9-10-13(11(12)14)8-6-4-2/h3-10H2,1-2H3
InChIKeyFXCPLDHPNOXGOM-UHFFFAOYSA-N
XLogP2.32
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1,3-dioctylimidazolidin-2-one
CID 19987667
1-butyl-3-(2-hydroxyethyl)-1,3-diazinan-2-one
CID 21270270
1-(3-chloropropyl)-3-ethylimidazolidin-2-one
CID 15078469
1,4-dibutylpiperazine-2,5-dione
CID 19902955
1-butyl-3-propan-2-yl-1,3-diazinan-2-one
CID 21025400
1,3-bis(2-propoxyethyl)imidazolidin-2-one
CID 139925751
2-(2-oxo-3-propylimidazolidin-1-yl)acetaldehyde
CID 84765786
1-butyl-3-methylimidazolidine-2,4-dione;ethane
CID 176672470
1-methyl-3-[3-(propylamino)propyl]imidazolidin-2-one
CID 62490656
1-decyl-3-hydroxy-1,3-diazinan-2-one
CID 15675482
1-butylpiperidine-2,4-dione
CID 79515410
N,N-diethyl-4-[2-(2-oxo-3-tetradecylimidazolidin-1-yl)ethyl]piperazine-1-carboxamide
CID 3033979

Frequently Asked Questions

What is the IUPAC name of 1,3-dibutylimidazolidin-2-one?
The IUPAC name of 1,3-dibutylimidazolidin-2-one (CID 20887) is 1,3-dibutylimidazolidin-2-one.
What is the SMILES notation for 1,3-dibutylimidazolidin-2-one?
The canonical SMILES for 1,3-dibutylimidazolidin-2-one is CCCCN1CCN(CCCC)C1=O.
What is the InChIKey of 1,3-dibutylimidazolidin-2-one?
The InChIKey is FXCPLDHPNOXGOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-3-5-7-12-9-10-13(11(12)14)8-6-4-2/h3-10H2,1-2H3.
What are the key properties of 1,3-dibutylimidazolidin-2-one?
1,3-dibutylimidazolidin-2-one has a molecular weight of 198.31 g/mol, XLogP of 2.32, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dibutylimidazolidin-2-one is sourced from PubChem (CID 20887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).