5-methyl-3-[(1-methylpyrrolidin-3-yl)methyl]imidazolidin-4-one

C10H19N3O — CID 83255711

IUPAC5-methyl-3-[(1-methylpyrrolidin-3-yl)methyl]imidazolidin-4-one
SMILESCC1NCN(CC2CCN(C)C2)C1=O
InChIInChI=1S/C10H19N3O/c1-8-10(14)13(7-11-8)6-9-3-4-12(2)5-9/h8-9,11H,3-7H2,1-2H3
InChIKeyCAEPELOXKRGPBM-UHFFFAOYSA-N
MW197.28 g/mol
LogP-0.28
Rot. Bonds2

About 5-methyl-3-[(1-methylpyrrolidin-3-yl)methyl]imidazolidin-4-one

5-methyl-3-[(1-methylpyrrolidin-3-yl)methyl]imidazolidin-4-one (PubChem CID 83255711) has the molecular formula C10H19N3O and a molecular weight of 197.28 g/mol. Its IUPAC name is 5-methyl-3-[(1-methylpyrrolidin-3-yl)methyl]imidazolidin-4-one.

Molecular Properties

Compound Name5-methyl-3-[(1-methylpyrrolidin-3-yl)methyl]imidazolidin-4-one
PubChem CID83255711
Molecular FormulaC10H19N3O
Molecular Weight197.28 g/mol
Exact Mass197.15
IUPAC Name5-methyl-3-[(1-methylpyrrolidin-3-yl)methyl]imidazolidin-4-one
SMILESCC1NCN(CC2CCN(C)C2)C1=O
InChIInChI=1S/C10H19N3O/c1-8-10(14)13(7-11-8)6-9-3-4-12(2)5-9/h8-9,11H,3-7H2,1-2H3
InChIKeyCAEPELOXKRGPBM-UHFFFAOYSA-N
XLogP-0.28
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 5-0.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-3-[(1-methylpyrrolidin-3-yl)methyl]imidazolidin-4-one?
The IUPAC name of 5-methyl-3-[(1-methylpyrrolidin-3-yl)methyl]imidazolidin-4-one (CID 83255711) is 5-methyl-3-[(1-methylpyrrolidin-3-yl)methyl]imidazolidin-4-one.
What is the SMILES notation for 5-methyl-3-[(1-methylpyrrolidin-3-yl)methyl]imidazolidin-4-one?
The canonical SMILES for 5-methyl-3-[(1-methylpyrrolidin-3-yl)methyl]imidazolidin-4-one is CC1NCN(CC2CCN(C)C2)C1=O.
What is the InChIKey of 5-methyl-3-[(1-methylpyrrolidin-3-yl)methyl]imidazolidin-4-one?
The InChIKey is CAEPELOXKRGPBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O/c1-8-10(14)13(7-11-8)6-9-3-4-12(2)5-9/h8-9,11H,3-7H2,1-2H3.
What are the key properties of 5-methyl-3-[(1-methylpyrrolidin-3-yl)methyl]imidazolidin-4-one?
5-methyl-3-[(1-methylpyrrolidin-3-yl)methyl]imidazolidin-4-one has a molecular weight of 197.28 g/mol, XLogP of -0.28, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-3-[(1-methylpyrrolidin-3-yl)methyl]imidazolidin-4-one is sourced from PubChem (CID 83255711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).