5-butyl-2-methyl-3-[2-(oxolan-2-yl)ethyl]imidazolidin-4-one

C14H26N2O2 — CID 83249315

IUPAC5-butyl-2-methyl-3-[2-(oxolan-2-yl)ethyl]imidazolidin-4-one
SMILESCCCCC1NC(C)N(CCC2CCCO2)C1=O
InChIInChI=1S/C14H26N2O2/c1-3-4-7-13-14(17)16(11(2)15-13)9-8-12-6-5-10-18-12/h11-13,15H,3-10H2,1-2H3
InChIKeyGIEKVFXBONORCA-UHFFFAOYSA-N
MW254.37 g/mol
LogP1.89
Rot. Bonds6

About 5-butyl-2-methyl-3-[2-(oxolan-2-yl)ethyl]imidazolidin-4-one

5-butyl-2-methyl-3-[2-(oxolan-2-yl)ethyl]imidazolidin-4-one (PubChem CID 83249315) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is 5-butyl-2-methyl-3-[2-(oxolan-2-yl)ethyl]imidazolidin-4-one.

Molecular Properties

Compound Name5-butyl-2-methyl-3-[2-(oxolan-2-yl)ethyl]imidazolidin-4-one
PubChem CID83249315
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Name5-butyl-2-methyl-3-[2-(oxolan-2-yl)ethyl]imidazolidin-4-one
SMILESCCCCC1NC(C)N(CCC2CCCO2)C1=O
InChIInChI=1S/C14H26N2O2/c1-3-4-7-13-14(17)16(11(2)15-13)9-8-12-6-5-10-18-12/h11-13,15H,3-10H2,1-2H3
InChIKeyGIEKVFXBONORCA-UHFFFAOYSA-N
XLogP1.89
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-benzyl-2-methyl-3-[2-(oxolan-2-yl)ethyl]imidazolidin-4-one
CID 83253136
5-ethyl-3-[2-(oxolan-2-yl)ethyl]-2-propylimidazolidin-4-one
CID 83248789
5-butyl-3-(cyclopropylmethyl)-2-methylimidazolidin-4-one
CID 83250992
5-(2-methylpropyl)-3-[2-(oxolan-2-yl)ethyl]-2-propylimidazolidin-4-one
CID 83248880
2-(2-methylpropyl)-3-[2-(oxan-2-yl)ethyl]-5-propylimidazolidin-4-one
CID 106000199
5-butyl-2-methyl-3-(oxolan-3-ylmethyl)imidazolidin-4-one
CID 83254553
5-butyl-2-methyl-3-(5-methylhexyl)imidazolidin-4-one
CID 83259831
5-butyl-3-[3-(dimethylamino)propyl]-2-methylimidazolidin-4-one
CID 83251042
2-ethyl-3-[2-(oxolan-2-yl)ethyl]-5-propan-2-ylimidazolidin-4-one
CID 83249092
3,6-dimethyl-1-[2-(oxolan-2-yl)ethyl]piperazine-2,5-dione
CID 64967006
5-methyl-2-(2-methylpropyl)-3-[2-(oxolan-2-yl)ethyl]imidazolidin-4-one
CID 83249314
6-ethyl-3-(2-methylpropyl)-1-[2-(oxolan-2-yl)ethyl]piperazine-2,5-dione
CID 64966897

Frequently Asked Questions

What is the IUPAC name of 5-butyl-2-methyl-3-[2-(oxolan-2-yl)ethyl]imidazolidin-4-one?
The IUPAC name of 5-butyl-2-methyl-3-[2-(oxolan-2-yl)ethyl]imidazolidin-4-one (CID 83249315) is 5-butyl-2-methyl-3-[2-(oxolan-2-yl)ethyl]imidazolidin-4-one.
What is the SMILES notation for 5-butyl-2-methyl-3-[2-(oxolan-2-yl)ethyl]imidazolidin-4-one?
The canonical SMILES for 5-butyl-2-methyl-3-[2-(oxolan-2-yl)ethyl]imidazolidin-4-one is CCCCC1NC(C)N(CCC2CCCO2)C1=O.
What is the InChIKey of 5-butyl-2-methyl-3-[2-(oxolan-2-yl)ethyl]imidazolidin-4-one?
The InChIKey is GIEKVFXBONORCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-3-4-7-13-14(17)16(11(2)15-13)9-8-12-6-5-10-18-12/h11-13,15H,3-10H2,1-2H3.
What are the key properties of 5-butyl-2-methyl-3-[2-(oxolan-2-yl)ethyl]imidazolidin-4-one?
5-butyl-2-methyl-3-[2-(oxolan-2-yl)ethyl]imidazolidin-4-one has a molecular weight of 254.37 g/mol, XLogP of 1.89, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-butyl-2-methyl-3-[2-(oxolan-2-yl)ethyl]imidazolidin-4-one is sourced from PubChem (CID 83249315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).