1-(7-bicyclo[4.1.0]heptanylmethyl)-3-methylimidazolidin-2-one

C12H20N2O — CID 132838874

IUPAC1-(7-bicyclo[4.1.0]heptanylmethyl)-3-methylimidazolidin-2-one
SMILESCN1CCN(CC2C3CCCCC32)C1=O
InChIInChI=1S/C12H20N2O/c1-13-6-7-14(12(13)15)8-11-9-4-2-3-5-10(9)11/h9-11H,2-8H2,1H3
InChIKeyAHEJSUYBZDXZJH-UHFFFAOYSA-N
MW208.30 g/mol
LogP1.79
Rot. Bonds2

About 1-(7-bicyclo[4.1.0]heptanylmethyl)-3-methylimidazolidin-2-one

1-(7-bicyclo[4.1.0]heptanylmethyl)-3-methylimidazolidin-2-one (PubChem CID 132838874) has the molecular formula C12H20N2O and a molecular weight of 208.30 g/mol. Its IUPAC name is 1-(7-bicyclo[4.1.0]heptanylmethyl)-3-methylimidazolidin-2-one.

Molecular Properties

Compound Name1-(7-bicyclo[4.1.0]heptanylmethyl)-3-methylimidazolidin-2-one
PubChem CID132838874
Molecular FormulaC12H20N2O
Molecular Weight208.30 g/mol
Exact Mass208.16
IUPAC Name1-(7-bicyclo[4.1.0]heptanylmethyl)-3-methylimidazolidin-2-one
SMILESCN1CCN(CC2C3CCCCC32)C1=O
InChIInChI=1S/C12H20N2O/c1-13-6-7-14(12(13)15)8-11-9-4-2-3-5-10(9)11/h9-11H,2-8H2,1H3
InChIKeyAHEJSUYBZDXZJH-UHFFFAOYSA-N
XLogP1.79
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 51.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(7-bicyclo[4.1.0]heptanylmethyl)-3-methylimidazolidin-2-one?
The IUPAC name of 1-(7-bicyclo[4.1.0]heptanylmethyl)-3-methylimidazolidin-2-one (CID 132838874) is 1-(7-bicyclo[4.1.0]heptanylmethyl)-3-methylimidazolidin-2-one.
What is the SMILES notation for 1-(7-bicyclo[4.1.0]heptanylmethyl)-3-methylimidazolidin-2-one?
The canonical SMILES for 1-(7-bicyclo[4.1.0]heptanylmethyl)-3-methylimidazolidin-2-one is CN1CCN(CC2C3CCCCC32)C1=O.
What is the InChIKey of 1-(7-bicyclo[4.1.0]heptanylmethyl)-3-methylimidazolidin-2-one?
The InChIKey is AHEJSUYBZDXZJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O/c1-13-6-7-14(12(13)15)8-11-9-4-2-3-5-10(9)11/h9-11H,2-8H2,1H3.
What are the key properties of 1-(7-bicyclo[4.1.0]heptanylmethyl)-3-methylimidazolidin-2-one?
1-(7-bicyclo[4.1.0]heptanylmethyl)-3-methylimidazolidin-2-one has a molecular weight of 208.30 g/mol, XLogP of 1.79, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-bicyclo[4.1.0]heptanylmethyl)-3-methylimidazolidin-2-one is sourced from PubChem (CID 132838874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).