1-methylimidazolidin-2-one;propan-2-one

C7H14N2O2 — CID 175161965

IUPAC1-methylimidazolidin-2-one;propan-2-one
SMILESCC(C)=O.CN1CCNC1=O
InChIInChI=1S/C4H8N2O.C3H6O/c1-6-3-2-5-4(6)7;1-3(2)4/h2-3H2,1H3,(H,5,7);1-2H3
InChIKeyACOMLNLBDMBVTQ-UHFFFAOYSA-N
MW158.20 g/mol
LogP0.24
Rot. Bonds

About 1-methylimidazolidin-2-one;propan-2-one

1-methylimidazolidin-2-one;propan-2-one (PubChem CID 175161965) has the molecular formula C7H14N2O2 and a molecular weight of 158.20 g/mol. Its IUPAC name is 1-methylimidazolidin-2-one;propan-2-one.

Molecular Properties

Compound Name1-methylimidazolidin-2-one;propan-2-one
PubChem CID175161965
Molecular FormulaC7H14N2O2
Molecular Weight158.20 g/mol
Exact Mass158.11
IUPAC Name1-methylimidazolidin-2-one;propan-2-one
SMILESCC(C)=O.CN1CCNC1=O
InChIInChI=1S/C4H8N2O.C3H6O/c1-6-3-2-5-4(6)7;1-3(2)4/h2-3H2,1H3,(H,5,7);1-2H3
InChIKeyACOMLNLBDMBVTQ-UHFFFAOYSA-N
XLogP0.24
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.20
LogP ≤ 50.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-methylimidazolidin-2-one;propan-2-one?
The IUPAC name of 1-methylimidazolidin-2-one;propan-2-one (CID 175161965) is 1-methylimidazolidin-2-one;propan-2-one.
What is the SMILES notation for 1-methylimidazolidin-2-one;propan-2-one?
The canonical SMILES for 1-methylimidazolidin-2-one;propan-2-one is CC(C)=O.CN1CCNC1=O.
What is the InChIKey of 1-methylimidazolidin-2-one;propan-2-one?
The InChIKey is ACOMLNLBDMBVTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8N2O.C3H6O/c1-6-3-2-5-4(6)7;1-3(2)4/h2-3H2,1H3,(H,5,7);1-2H3.
What are the key properties of 1-methylimidazolidin-2-one;propan-2-one?
1-methylimidazolidin-2-one;propan-2-one has a molecular weight of 158.20 g/mol, XLogP of 0.24, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methylimidazolidin-2-one;propan-2-one is sourced from PubChem (CID 175161965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).