1-[2-(4-amino-3-ethylpiperidin-1-yl)acetyl]imidazolidin-2-one

C12H22N4O2 — CID 81459873

IUPAC1-[2-(4-amino-3-ethylpiperidin-1-yl)acetyl]imidazolidin-2-one
SMILESCCC1CN(CC(=O)N2CCNC2=O)CCC1N
InChIInChI=1S/C12H22N4O2/c1-2-9-7-15(5-3-10(9)13)8-11(17)16-6-4-14-12(16)18/h9-10H,2-8,13H2,1H3,(H,14,18)
InChIKeyWOGJGWAAULCDEQ-UHFFFAOYSA-N
MW254.33 g/mol
LogP-0.40
Rot. Bonds3

About 1-[2-(4-amino-3-ethylpiperidin-1-yl)acetyl]imidazolidin-2-one

1-[2-(4-amino-3-ethylpiperidin-1-yl)acetyl]imidazolidin-2-one (PubChem CID 81459873) has the molecular formula C12H22N4O2 and a molecular weight of 254.33 g/mol. Its IUPAC name is 1-[2-(4-amino-3-ethylpiperidin-1-yl)acetyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[2-(4-amino-3-ethylpiperidin-1-yl)acetyl]imidazolidin-2-one
PubChem CID81459873
Molecular FormulaC12H22N4O2
Molecular Weight254.33 g/mol
Exact Mass254.17
IUPAC Name1-[2-(4-amino-3-ethylpiperidin-1-yl)acetyl]imidazolidin-2-one
SMILESCCC1CN(CC(=O)N2CCNC2=O)CCC1N
InChIInChI=1S/C12H22N4O2/c1-2-9-7-15(5-3-10(9)13)8-11(17)16-6-4-14-12(16)18/h9-10H,2-8,13H2,1H3,(H,14,18)
InChIKeyWOGJGWAAULCDEQ-UHFFFAOYSA-N
XLogP-0.40
TPSA78.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 5-0.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-[2-(4-amino-3-ethylpiperidin-1-yl)acetyl]imidazolidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-amino-3-ethylpiperidin-1-yl)acetyl]imidazolidin-2-one?
The IUPAC name of 1-[2-(4-amino-3-ethylpiperidin-1-yl)acetyl]imidazolidin-2-one (CID 81459873) is 1-[2-(4-amino-3-ethylpiperidin-1-yl)acetyl]imidazolidin-2-one.
What is the SMILES notation for 1-[2-(4-amino-3-ethylpiperidin-1-yl)acetyl]imidazolidin-2-one?
The canonical SMILES for 1-[2-(4-amino-3-ethylpiperidin-1-yl)acetyl]imidazolidin-2-one is CCC1CN(CC(=O)N2CCNC2=O)CCC1N.
What is the InChIKey of 1-[2-(4-amino-3-ethylpiperidin-1-yl)acetyl]imidazolidin-2-one?
The InChIKey is WOGJGWAAULCDEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4O2/c1-2-9-7-15(5-3-10(9)13)8-11(17)16-6-4-14-12(16)18/h9-10H,2-8,13H2,1H3,(H,14,18).
What are the key properties of 1-[2-(4-amino-3-ethylpiperidin-1-yl)acetyl]imidazolidin-2-one?
1-[2-(4-amino-3-ethylpiperidin-1-yl)acetyl]imidazolidin-2-one has a molecular weight of 254.33 g/mol, XLogP of -0.40, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-amino-3-ethylpiperidin-1-yl)acetyl]imidazolidin-2-one is sourced from PubChem (CID 81459873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).