1-[1-(3-cyclopentylpropanoyl)piperidin-4-yl]-3-ethylimidazolidin-2-one

C18H31N3O2 — CID 46335574

IUPAC1-[1-(3-cyclopentylpropanoyl)piperidin-4-yl]-3-ethylimidazolidin-2-one
SMILESCCN1CCN(C2CCN(C(=O)CCC3CCCC3)CC2)C1=O
InChIInChI=1S/C18H31N3O2/c1-2-19-13-14-21(18(19)23)16-9-11-20(12-10-16)17(22)8-7-15-5-3-4-6-15/h15-16H,2-14H2,1H3
InChIKeyLRUBIYCRIVAWQW-UHFFFAOYSA-N
MW321.47 g/mol
LogP2.71
Rot. Bonds5

About 1-[1-(3-cyclopentylpropanoyl)piperidin-4-yl]-3-ethylimidazolidin-2-one

1-[1-(3-cyclopentylpropanoyl)piperidin-4-yl]-3-ethylimidazolidin-2-one (PubChem CID 46335574) has the molecular formula C18H31N3O2 and a molecular weight of 321.47 g/mol. Its IUPAC name is 1-[1-(3-cyclopentylpropanoyl)piperidin-4-yl]-3-ethylimidazolidin-2-one.

Molecular Properties

Compound Name1-[1-(3-cyclopentylpropanoyl)piperidin-4-yl]-3-ethylimidazolidin-2-one
PubChem CID46335574
Molecular FormulaC18H31N3O2
Molecular Weight321.47 g/mol
Exact Mass321.24
IUPAC Name1-[1-(3-cyclopentylpropanoyl)piperidin-4-yl]-3-ethylimidazolidin-2-one
SMILESCCN1CCN(C2CCN(C(=O)CCC3CCCC3)CC2)C1=O
InChIInChI=1S/C18H31N3O2/c1-2-19-13-14-21(18(19)23)16-9-11-20(12-10-16)17(22)8-7-15-5-3-4-6-15/h15-16H,2-14H2,1H3
InChIKeyLRUBIYCRIVAWQW-UHFFFAOYSA-N
XLogP2.71
TPSA43.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.47
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(3-cyclopentylpropanoyl)piperidin-4-yl]-3-ethylimidazolidin-2-one?
The IUPAC name of 1-[1-(3-cyclopentylpropanoyl)piperidin-4-yl]-3-ethylimidazolidin-2-one (CID 46335574) is 1-[1-(3-cyclopentylpropanoyl)piperidin-4-yl]-3-ethylimidazolidin-2-one.
What is the SMILES notation for 1-[1-(3-cyclopentylpropanoyl)piperidin-4-yl]-3-ethylimidazolidin-2-one?
The canonical SMILES for 1-[1-(3-cyclopentylpropanoyl)piperidin-4-yl]-3-ethylimidazolidin-2-one is CCN1CCN(C2CCN(C(=O)CCC3CCCC3)CC2)C1=O.
What is the InChIKey of 1-[1-(3-cyclopentylpropanoyl)piperidin-4-yl]-3-ethylimidazolidin-2-one?
The InChIKey is LRUBIYCRIVAWQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H31N3O2/c1-2-19-13-14-21(18(19)23)16-9-11-20(12-10-16)17(22)8-7-15-5-3-4-6-15/h15-16H,2-14H2,1H3.
What are the key properties of 1-[1-(3-cyclopentylpropanoyl)piperidin-4-yl]-3-ethylimidazolidin-2-one?
1-[1-(3-cyclopentylpropanoyl)piperidin-4-yl]-3-ethylimidazolidin-2-one has a molecular weight of 321.47 g/mol, XLogP of 2.71, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(3-cyclopentylpropanoyl)piperidin-4-yl]-3-ethylimidazolidin-2-one is sourced from PubChem (CID 46335574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).