1-[(2-methyloxolan-2-yl)methyl]imidazolidin-2-one

C9H16N2O2 — CID 115370802

IUPAC1-[(2-methyloxolan-2-yl)methyl]imidazolidin-2-one
SMILESCC1(CN2CCNC2=O)CCCO1
InChIInChI=1S/C9H16N2O2/c1-9(3-2-6-13-9)7-11-5-4-10-8(11)12/h2-7H2,1H3,(H,10,12)
InChIKeyAYMLCNTUECXIFN-UHFFFAOYSA-N
MW184.24 g/mol
LogP0.58
Rot. Bonds2

About 1-[(2-methyloxolan-2-yl)methyl]imidazolidin-2-one

1-[(2-methyloxolan-2-yl)methyl]imidazolidin-2-one (PubChem CID 115370802) has the molecular formula C9H16N2O2 and a molecular weight of 184.24 g/mol. Its IUPAC name is 1-[(2-methyloxolan-2-yl)methyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[(2-methyloxolan-2-yl)methyl]imidazolidin-2-one
PubChem CID115370802
Molecular FormulaC9H16N2O2
Molecular Weight184.24 g/mol
Exact Mass184.12
IUPAC Name1-[(2-methyloxolan-2-yl)methyl]imidazolidin-2-one
SMILESCC1(CN2CCNC2=O)CCCO1
InChIInChI=1S/C9H16N2O2/c1-9(3-2-6-13-9)7-11-5-4-10-8(11)12/h2-7H2,1H3,(H,10,12)
InChIKeyAYMLCNTUECXIFN-UHFFFAOYSA-N
XLogP0.58
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.24
LogP ≤ 50.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[(2-methyloxolan-2-yl)methyl]imidazolidin-2-one?
The IUPAC name of 1-[(2-methyloxolan-2-yl)methyl]imidazolidin-2-one (CID 115370802) is 1-[(2-methyloxolan-2-yl)methyl]imidazolidin-2-one.
What is the SMILES notation for 1-[(2-methyloxolan-2-yl)methyl]imidazolidin-2-one?
The canonical SMILES for 1-[(2-methyloxolan-2-yl)methyl]imidazolidin-2-one is CC1(CN2CCNC2=O)CCCO1.
What is the InChIKey of 1-[(2-methyloxolan-2-yl)methyl]imidazolidin-2-one?
The InChIKey is AYMLCNTUECXIFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O2/c1-9(3-2-6-13-9)7-11-5-4-10-8(11)12/h2-7H2,1H3,(H,10,12).
What are the key properties of 1-[(2-methyloxolan-2-yl)methyl]imidazolidin-2-one?
1-[(2-methyloxolan-2-yl)methyl]imidazolidin-2-one has a molecular weight of 184.24 g/mol, XLogP of 0.58, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-methyloxolan-2-yl)methyl]imidazolidin-2-one is sourced from PubChem (CID 115370802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).