1-[2-(4-benzoylpiperazin-1-yl)ethyl]imidazolidin-2-one

C16H22N4O2 — CID 14208334

IUPAC1-[2-(4-benzoylpiperazin-1-yl)ethyl]imidazolidin-2-one
SMILESO=C1NCCN1CCN1CCN(C(=O)c2ccccc2)CC1
InChIInChI=1S/C16H22N4O2/c21-15(14-4-2-1-3-5-14)19-11-8-18(9-12-19)10-13-20-7-6-17-16(20)22/h1-5H,6-13H2,(H,17,22)
InChIKeyICPKTAVYZBVYRF-UHFFFAOYSA-N
MW302.38 g/mol
LogP0.47
Rot. Bonds4

About 1-[2-(4-benzoylpiperazin-1-yl)ethyl]imidazolidin-2-one

1-[2-(4-benzoylpiperazin-1-yl)ethyl]imidazolidin-2-one (PubChem CID 14208334) has the molecular formula C16H22N4O2 and a molecular weight of 302.38 g/mol. Its IUPAC name is 1-[2-(4-benzoylpiperazin-1-yl)ethyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[2-(4-benzoylpiperazin-1-yl)ethyl]imidazolidin-2-one
PubChem CID14208334
Molecular FormulaC16H22N4O2
Molecular Weight302.38 g/mol
Exact Mass302.17
IUPAC Name1-[2-(4-benzoylpiperazin-1-yl)ethyl]imidazolidin-2-one
SMILESO=C1NCCN1CCN1CCN(C(=O)c2ccccc2)CC1
InChIInChI=1S/C16H22N4O2/c21-15(14-4-2-1-3-5-14)19-11-8-18(9-12-19)10-13-20-7-6-17-16(20)22/h1-5H,6-13H2,(H,17,22)
InChIKeyICPKTAVYZBVYRF-UHFFFAOYSA-N
XLogP0.47
TPSA55.89 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.38
LogP ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-benzoylpiperazin-1-yl)ethyl]imidazolidin-2-one?
The IUPAC name of 1-[2-(4-benzoylpiperazin-1-yl)ethyl]imidazolidin-2-one (CID 14208334) is 1-[2-(4-benzoylpiperazin-1-yl)ethyl]imidazolidin-2-one.
What is the SMILES notation for 1-[2-(4-benzoylpiperazin-1-yl)ethyl]imidazolidin-2-one?
The canonical SMILES for 1-[2-(4-benzoylpiperazin-1-yl)ethyl]imidazolidin-2-one is O=C1NCCN1CCN1CCN(C(=O)c2ccccc2)CC1.
What is the InChIKey of 1-[2-(4-benzoylpiperazin-1-yl)ethyl]imidazolidin-2-one?
The InChIKey is ICPKTAVYZBVYRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4O2/c21-15(14-4-2-1-3-5-14)19-11-8-18(9-12-19)10-13-20-7-6-17-16(20)22/h1-5H,6-13H2,(H,17,22).
What are the key properties of 1-[2-(4-benzoylpiperazin-1-yl)ethyl]imidazolidin-2-one?
1-[2-(4-benzoylpiperazin-1-yl)ethyl]imidazolidin-2-one has a molecular weight of 302.38 g/mol, XLogP of 0.47, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-benzoylpiperazin-1-yl)ethyl]imidazolidin-2-one is sourced from PubChem (CID 14208334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).