3-methyl-1-(1-methylcyclopropanecarbonyl)imidazolidin-4-one

C9H14N2O2 — CID 130678726

IUPAC3-methyl-1-(1-methylcyclopropanecarbonyl)imidazolidin-4-one
SMILESCN1CN(C(=O)C2(C)CC2)CC1=O
InChIInChI=1S/C9H14N2O2/c1-9(3-4-9)8(13)11-5-7(12)10(2)6-11/h3-6H2,1-2H3
InChIKeyFCVRJHQWSADEQK-UHFFFAOYSA-N
MW182.22 g/mol
LogP0.04
Rot. Bonds1

About 3-methyl-1-(1-methylcyclopropanecarbonyl)imidazolidin-4-one

3-methyl-1-(1-methylcyclopropanecarbonyl)imidazolidin-4-one (PubChem CID 130678726) has the molecular formula C9H14N2O2 and a molecular weight of 182.22 g/mol. Its IUPAC name is 3-methyl-1-(1-methylcyclopropanecarbonyl)imidazolidin-4-one.

Molecular Properties

Compound Name3-methyl-1-(1-methylcyclopropanecarbonyl)imidazolidin-4-one
PubChem CID130678726
Molecular FormulaC9H14N2O2
Molecular Weight182.22 g/mol
Exact Mass182.11
IUPAC Name3-methyl-1-(1-methylcyclopropanecarbonyl)imidazolidin-4-one
SMILESCN1CN(C(=O)C2(C)CC2)CC1=O
InChIInChI=1S/C9H14N2O2/c1-9(3-4-9)8(13)11-5-7(12)10(2)6-11/h3-6H2,1-2H3
InChIKeyFCVRJHQWSADEQK-UHFFFAOYSA-N
XLogP0.04
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.22
LogP ≤ 50.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-(1-methylcyclopropanecarbonyl)imidazolidin-4-one?
The IUPAC name of 3-methyl-1-(1-methylcyclopropanecarbonyl)imidazolidin-4-one (CID 130678726) is 3-methyl-1-(1-methylcyclopropanecarbonyl)imidazolidin-4-one.
What is the SMILES notation for 3-methyl-1-(1-methylcyclopropanecarbonyl)imidazolidin-4-one?
The canonical SMILES for 3-methyl-1-(1-methylcyclopropanecarbonyl)imidazolidin-4-one is CN1CN(C(=O)C2(C)CC2)CC1=O.
What is the InChIKey of 3-methyl-1-(1-methylcyclopropanecarbonyl)imidazolidin-4-one?
The InChIKey is FCVRJHQWSADEQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O2/c1-9(3-4-9)8(13)11-5-7(12)10(2)6-11/h3-6H2,1-2H3.
What are the key properties of 3-methyl-1-(1-methylcyclopropanecarbonyl)imidazolidin-4-one?
3-methyl-1-(1-methylcyclopropanecarbonyl)imidazolidin-4-one has a molecular weight of 182.22 g/mol, XLogP of 0.04, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-(1-methylcyclopropanecarbonyl)imidazolidin-4-one is sourced from PubChem (CID 130678726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).