1,3-dimethylimidazolidin-2-one;bis(1,3-dimethylpyrrolidin-2-one)

C17H32N4O3 — CID 160661672

IUPAC1,3-dimethylimidazolidin-2-one;bis(1,3-dimethylpyrrolidin-2-one)
SMILESCC1CCN(C)C1=O.CC1CCN(C)C1=O.CN1CCN(C)C1=O
InChIInChI=1S/2C6H11NO.C5H10N2O/c2*1-5-3-4-7(2)6(5)8;1-6-3-4-7(2)5(6)8/h2*5H,3-4H2,1-2H3;3-4H2,1-2H3
InChIKeyRLTDEUILIXNYAQ-UHFFFAOYSA-N
MW340.47 g/mol
LogP0.95
Rot. Bonds

About 1,3-dimethylimidazolidin-2-one;bis(1,3-dimethylpyrrolidin-2-one)

1,3-dimethylimidazolidin-2-one;bis(1,3-dimethylpyrrolidin-2-one) (PubChem CID 160661672) has the molecular formula C17H32N4O3 and a molecular weight of 340.47 g/mol. Its IUPAC name is 1,3-dimethylimidazolidin-2-one;bis(1,3-dimethylpyrrolidin-2-one).

Molecular Properties

Compound Name1,3-dimethylimidazolidin-2-one;bis(1,3-dimethylpyrrolidin-2-one)
PubChem CID160661672
Molecular FormulaC17H32N4O3
Molecular Weight340.47 g/mol
Exact Mass340.25
IUPAC Name1,3-dimethylimidazolidin-2-one;bis(1,3-dimethylpyrrolidin-2-one)
SMILESCC1CCN(C)C1=O.CC1CCN(C)C1=O.CN1CCN(C)C1=O
InChIInChI=1S/2C6H11NO.C5H10N2O/c2*1-5-3-4-7(2)6(5)8;1-6-3-4-7(2)5(6)8/h2*5H,3-4H2,1-2H3;3-4H2,1-2H3
InChIKeyRLTDEUILIXNYAQ-UHFFFAOYSA-N
XLogP0.95
TPSA64.17 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.47
LogP ≤ 50.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1,3-dimethylimidazolidin-2-one;bis(1,3-dimethylpyrrolidin-2-one)?
The IUPAC name of 1,3-dimethylimidazolidin-2-one;bis(1,3-dimethylpyrrolidin-2-one) (CID 160661672) is 1,3-dimethylimidazolidin-2-one;bis(1,3-dimethylpyrrolidin-2-one).
What is the SMILES notation for 1,3-dimethylimidazolidin-2-one;bis(1,3-dimethylpyrrolidin-2-one)?
The canonical SMILES for 1,3-dimethylimidazolidin-2-one;bis(1,3-dimethylpyrrolidin-2-one) is CC1CCN(C)C1=O.CC1CCN(C)C1=O.CN1CCN(C)C1=O.
What is the InChIKey of 1,3-dimethylimidazolidin-2-one;bis(1,3-dimethylpyrrolidin-2-one)?
The InChIKey is RLTDEUILIXNYAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C6H11NO.C5H10N2O/c2*1-5-3-4-7(2)6(5)8;1-6-3-4-7(2)5(6)8/h2*5H,3-4H2,1-2H3;3-4H2,1-2H3.
What are the key properties of 1,3-dimethylimidazolidin-2-one;bis(1,3-dimethylpyrrolidin-2-one)?
1,3-dimethylimidazolidin-2-one;bis(1,3-dimethylpyrrolidin-2-one) has a molecular weight of 340.47 g/mol, XLogP of 0.95, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethylimidazolidin-2-one;bis(1,3-dimethylpyrrolidin-2-one) is sourced from PubChem (CID 160661672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).