1-[1-[2-(methylamino)acetyl]piperidin-4-yl]imidazolidin-2-one

C11H20N4O2 — CID 54872430

IUPAC1-[1-[2-(methylamino)acetyl]piperidin-4-yl]imidazolidin-2-one
SMILESCNCC(=O)N1CCC(N2CCNC2=O)CC1
InChIInChI=1S/C11H20N4O2/c1-12-8-10(16)14-5-2-9(3-6-14)15-7-4-13-11(15)17/h9,12H,2-8H2,1H3,(H,13,17)
InChIKeyDUGSDWANJYYFBB-UHFFFAOYSA-N
MW240.31 g/mol
LogP-0.78
Rot. Bonds3

About 1-[1-[2-(methylamino)acetyl]piperidin-4-yl]imidazolidin-2-one

1-[1-[2-(methylamino)acetyl]piperidin-4-yl]imidazolidin-2-one (PubChem CID 54872430) has the molecular formula C11H20N4O2 and a molecular weight of 240.31 g/mol. Its IUPAC name is 1-[1-[2-(methylamino)acetyl]piperidin-4-yl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[1-[2-(methylamino)acetyl]piperidin-4-yl]imidazolidin-2-one
PubChem CID54872430
Molecular FormulaC11H20N4O2
Molecular Weight240.31 g/mol
Exact Mass240.16
IUPAC Name1-[1-[2-(methylamino)acetyl]piperidin-4-yl]imidazolidin-2-one
SMILESCNCC(=O)N1CCC(N2CCNC2=O)CC1
InChIInChI=1S/C11H20N4O2/c1-12-8-10(16)14-5-2-9(3-6-14)15-7-4-13-11(15)17/h9,12H,2-8H2,1H3,(H,13,17)
InChIKeyDUGSDWANJYYFBB-UHFFFAOYSA-N
XLogP-0.78
TPSA64.68 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 5-0.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[1-[2-(methylamino)acetyl]piperidin-4-yl]imidazolidin-2-one?
The IUPAC name of 1-[1-[2-(methylamino)acetyl]piperidin-4-yl]imidazolidin-2-one (CID 54872430) is 1-[1-[2-(methylamino)acetyl]piperidin-4-yl]imidazolidin-2-one.
What is the SMILES notation for 1-[1-[2-(methylamino)acetyl]piperidin-4-yl]imidazolidin-2-one?
The canonical SMILES for 1-[1-[2-(methylamino)acetyl]piperidin-4-yl]imidazolidin-2-one is CNCC(=O)N1CCC(N2CCNC2=O)CC1.
What is the InChIKey of 1-[1-[2-(methylamino)acetyl]piperidin-4-yl]imidazolidin-2-one?
The InChIKey is DUGSDWANJYYFBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O2/c1-12-8-10(16)14-5-2-9(3-6-14)15-7-4-13-11(15)17/h9,12H,2-8H2,1H3,(H,13,17).
What are the key properties of 1-[1-[2-(methylamino)acetyl]piperidin-4-yl]imidazolidin-2-one?
1-[1-[2-(methylamino)acetyl]piperidin-4-yl]imidazolidin-2-one has a molecular weight of 240.31 g/mol, XLogP of -0.78, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[2-(methylamino)acetyl]piperidin-4-yl]imidazolidin-2-one is sourced from PubChem (CID 54872430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).