1-methyl-3-(1-methylpyrazol-3-yl)imidazolidin-2-one

C8H12N4O — CID 118061369

IUPAC1-methyl-3-(1-methylpyrazol-3-yl)imidazolidin-2-one
SMILESCN1CCN(c2ccn(C)n2)C1=O
InChIInChI=1S/C8H12N4O/c1-10-5-6-12(8(10)13)7-3-4-11(2)9-7/h3-4H,5-6H2,1-2H3
InChIKeyJZLYMBDHLFYLFL-UHFFFAOYSA-N
MW180.21 g/mol
LogP0.29
Rot. Bonds1

About 1-methyl-3-(1-methylpyrazol-3-yl)imidazolidin-2-one

1-methyl-3-(1-methylpyrazol-3-yl)imidazolidin-2-one (PubChem CID 118061369) has the molecular formula C8H12N4O and a molecular weight of 180.21 g/mol. Its IUPAC name is 1-methyl-3-(1-methylpyrazol-3-yl)imidazolidin-2-one.

Molecular Properties

Compound Name1-methyl-3-(1-methylpyrazol-3-yl)imidazolidin-2-one
PubChem CID118061369
Molecular FormulaC8H12N4O
Molecular Weight180.21 g/mol
Exact Mass180.10
IUPAC Name1-methyl-3-(1-methylpyrazol-3-yl)imidazolidin-2-one
SMILESCN1CCN(c2ccn(C)n2)C1=O
InChIInChI=1S/C8H12N4O/c1-10-5-6-12(8(10)13)7-3-4-11(2)9-7/h3-4H,5-6H2,1-2H3
InChIKeyJZLYMBDHLFYLFL-UHFFFAOYSA-N
XLogP0.29
TPSA41.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.21
LogP ≤ 50.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-(1-methylpyrazol-3-yl)imidazolidin-2-one?
The IUPAC name of 1-methyl-3-(1-methylpyrazol-3-yl)imidazolidin-2-one (CID 118061369) is 1-methyl-3-(1-methylpyrazol-3-yl)imidazolidin-2-one.
What is the SMILES notation for 1-methyl-3-(1-methylpyrazol-3-yl)imidazolidin-2-one?
The canonical SMILES for 1-methyl-3-(1-methylpyrazol-3-yl)imidazolidin-2-one is CN1CCN(c2ccn(C)n2)C1=O.
What is the InChIKey of 1-methyl-3-(1-methylpyrazol-3-yl)imidazolidin-2-one?
The InChIKey is JZLYMBDHLFYLFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4O/c1-10-5-6-12(8(10)13)7-3-4-11(2)9-7/h3-4H,5-6H2,1-2H3.
What are the key properties of 1-methyl-3-(1-methylpyrazol-3-yl)imidazolidin-2-one?
1-methyl-3-(1-methylpyrazol-3-yl)imidazolidin-2-one has a molecular weight of 180.21 g/mol, XLogP of 0.29, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-(1-methylpyrazol-3-yl)imidazolidin-2-one is sourced from PubChem (CID 118061369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).