1-phenyl-5-(2-piperidin-4-ylethyl)imidazolidin-2-one

C16H23N3O — CID 70068320

IUPAC1-phenyl-5-(2-piperidin-4-ylethyl)imidazolidin-2-one
SMILESO=C1NCC(CCC2CCNCC2)N1c1ccccc1
InChIInChI=1S/C16H23N3O/c20-16-18-12-15(7-6-13-8-10-17-11-9-13)19(16)14-4-2-1-3-5-14/h1-5,13,15,17H,6-12H2,(H,18,20)
InChIKeyAVVVCQRTLNHMRM-UHFFFAOYSA-N
MW273.38 g/mol
LogP2.36
Rot. Bonds4

About 1-phenyl-5-(2-piperidin-4-ylethyl)imidazolidin-2-one

1-phenyl-5-(2-piperidin-4-ylethyl)imidazolidin-2-one (PubChem CID 70068320) has the molecular formula C16H23N3O and a molecular weight of 273.38 g/mol. Its IUPAC name is 1-phenyl-5-(2-piperidin-4-ylethyl)imidazolidin-2-one.

Molecular Properties

Compound Name1-phenyl-5-(2-piperidin-4-ylethyl)imidazolidin-2-one
PubChem CID70068320
Molecular FormulaC16H23N3O
Molecular Weight273.38 g/mol
Exact Mass273.18
IUPAC Name1-phenyl-5-(2-piperidin-4-ylethyl)imidazolidin-2-one
SMILESO=C1NCC(CCC2CCNCC2)N1c1ccccc1
InChIInChI=1S/C16H23N3O/c20-16-18-12-15(7-6-13-8-10-17-11-9-13)19(16)14-4-2-1-3-5-14/h1-5,13,15,17H,6-12H2,(H,18,20)
InChIKeyAVVVCQRTLNHMRM-UHFFFAOYSA-N
XLogP2.36
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-phenyl-5-(2-piperidin-4-ylethyl)imidazolidin-2-one?
The IUPAC name of 1-phenyl-5-(2-piperidin-4-ylethyl)imidazolidin-2-one (CID 70068320) is 1-phenyl-5-(2-piperidin-4-ylethyl)imidazolidin-2-one.
What is the SMILES notation for 1-phenyl-5-(2-piperidin-4-ylethyl)imidazolidin-2-one?
The canonical SMILES for 1-phenyl-5-(2-piperidin-4-ylethyl)imidazolidin-2-one is O=C1NCC(CCC2CCNCC2)N1c1ccccc1.
What is the InChIKey of 1-phenyl-5-(2-piperidin-4-ylethyl)imidazolidin-2-one?
The InChIKey is AVVVCQRTLNHMRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O/c20-16-18-12-15(7-6-13-8-10-17-11-9-13)19(16)14-4-2-1-3-5-14/h1-5,13,15,17H,6-12H2,(H,18,20).
What are the key properties of 1-phenyl-5-(2-piperidin-4-ylethyl)imidazolidin-2-one?
1-phenyl-5-(2-piperidin-4-ylethyl)imidazolidin-2-one has a molecular weight of 273.38 g/mol, XLogP of 2.36, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-5-(2-piperidin-4-ylethyl)imidazolidin-2-one is sourced from PubChem (CID 70068320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).