3-(2-methoxyethyl)-1-(piperidin-4-ylmethyl)imidazolidin-4-one;hydrochloride

C12H24ClN3O2 — CID 120857386

IUPAC3-(2-methoxyethyl)-1-(piperidin-4-ylmethyl)imidazolidin-4-one;hydrochloride
SMILESCOCCN1CN(CC2CCNCC2)CC1=O.Cl
InChIInChI=1S/C12H23N3O2.ClH/c1-17-7-6-15-10-14(9-12(15)16)8-11-2-4-13-5-3-11;/h11,13H,2-10H2,1H3;1H
InChIKeyQGBFXLAHCMJIKW-UHFFFAOYSA-N
MW277.80 g/mol
LogP0.16
Rot. Bonds5

About 3-(2-methoxyethyl)-1-(piperidin-4-ylmethyl)imidazolidin-4-one;hydrochloride

3-(2-methoxyethyl)-1-(piperidin-4-ylmethyl)imidazolidin-4-one;hydrochloride (PubChem CID 120857386) has the molecular formula C12H24ClN3O2 and a molecular weight of 277.80 g/mol. Its IUPAC name is 3-(2-methoxyethyl)-1-(piperidin-4-ylmethyl)imidazolidin-4-one;hydrochloride.

Molecular Properties

Compound Name3-(2-methoxyethyl)-1-(piperidin-4-ylmethyl)imidazolidin-4-one;hydrochloride
PubChem CID120857386
Molecular FormulaC12H24ClN3O2
Molecular Weight277.80 g/mol
Exact Mass277.16
IUPAC Name3-(2-methoxyethyl)-1-(piperidin-4-ylmethyl)imidazolidin-4-one;hydrochloride
SMILESCOCCN1CN(CC2CCNCC2)CC1=O.Cl
InChIInChI=1S/C12H23N3O2.ClH/c1-17-7-6-15-10-14(9-12(15)16)8-11-2-4-13-5-3-11;/h11,13H,2-10H2,1H3;1H
InChIKeyQGBFXLAHCMJIKW-UHFFFAOYSA-N
XLogP0.16
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.80
LogP ≤ 50.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyethyl)-1-(piperidin-4-ylmethyl)imidazolidin-4-one;hydrochloride?
The IUPAC name of 3-(2-methoxyethyl)-1-(piperidin-4-ylmethyl)imidazolidin-4-one;hydrochloride (CID 120857386) is 3-(2-methoxyethyl)-1-(piperidin-4-ylmethyl)imidazolidin-4-one;hydrochloride.
What is the SMILES notation for 3-(2-methoxyethyl)-1-(piperidin-4-ylmethyl)imidazolidin-4-one;hydrochloride?
The canonical SMILES for 3-(2-methoxyethyl)-1-(piperidin-4-ylmethyl)imidazolidin-4-one;hydrochloride is COCCN1CN(CC2CCNCC2)CC1=O.Cl.
What is the InChIKey of 3-(2-methoxyethyl)-1-(piperidin-4-ylmethyl)imidazolidin-4-one;hydrochloride?
The InChIKey is QGBFXLAHCMJIKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2.ClH/c1-17-7-6-15-10-14(9-12(15)16)8-11-2-4-13-5-3-11;/h11,13H,2-10H2,1H3;1H.
What are the key properties of 3-(2-methoxyethyl)-1-(piperidin-4-ylmethyl)imidazolidin-4-one;hydrochloride?
3-(2-methoxyethyl)-1-(piperidin-4-ylmethyl)imidazolidin-4-one;hydrochloride has a molecular weight of 277.80 g/mol, XLogP of 0.16, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyethyl)-1-(piperidin-4-ylmethyl)imidazolidin-4-one;hydrochloride is sourced from PubChem (CID 120857386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).