1-[4-(1-cyclopentylethylamino)phenyl]imidazolidin-2-one

C16H23N3O — CID 62631563

IUPAC1-[4-(1-cyclopentylethylamino)phenyl]imidazolidin-2-one
SMILESCC(Nc1ccc(N2CCNC2=O)cc1)C1CCCC1
InChIInChI=1S/C16H23N3O/c1-12(13-4-2-3-5-13)18-14-6-8-15(9-7-14)19-11-10-17-16(19)20/h6-9,12-13,18H,2-5,10-11H2,1H3,(H,17,20)
InChIKeyALVXBOZSUPVSKE-UHFFFAOYSA-N
MW273.38 g/mol
LogP3.21
Rot. Bonds4

About 1-[4-(1-cyclopentylethylamino)phenyl]imidazolidin-2-one

1-[4-(1-cyclopentylethylamino)phenyl]imidazolidin-2-one (PubChem CID 62631563) has the molecular formula C16H23N3O and a molecular weight of 273.38 g/mol. Its IUPAC name is 1-[4-(1-cyclopentylethylamino)phenyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[4-(1-cyclopentylethylamino)phenyl]imidazolidin-2-one
PubChem CID62631563
Molecular FormulaC16H23N3O
Molecular Weight273.38 g/mol
Exact Mass273.18
IUPAC Name1-[4-(1-cyclopentylethylamino)phenyl]imidazolidin-2-one
SMILESCC(Nc1ccc(N2CCNC2=O)cc1)C1CCCC1
InChIInChI=1S/C16H23N3O/c1-12(13-4-2-3-5-13)18-14-6-8-15(9-7-14)19-11-10-17-16(19)20/h6-9,12-13,18H,2-5,10-11H2,1H3,(H,17,20)
InChIKeyALVXBOZSUPVSKE-UHFFFAOYSA-N
XLogP3.21
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 ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[4-(1-cyclopentylethylamino)phenyl]imidazolidin-2-one?
The IUPAC name of 1-[4-(1-cyclopentylethylamino)phenyl]imidazolidin-2-one (CID 62631563) is 1-[4-(1-cyclopentylethylamino)phenyl]imidazolidin-2-one.
What is the SMILES notation for 1-[4-(1-cyclopentylethylamino)phenyl]imidazolidin-2-one?
The canonical SMILES for 1-[4-(1-cyclopentylethylamino)phenyl]imidazolidin-2-one is CC(Nc1ccc(N2CCNC2=O)cc1)C1CCCC1.
What is the InChIKey of 1-[4-(1-cyclopentylethylamino)phenyl]imidazolidin-2-one?
The InChIKey is ALVXBOZSUPVSKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O/c1-12(13-4-2-3-5-13)18-14-6-8-15(9-7-14)19-11-10-17-16(19)20/h6-9,12-13,18H,2-5,10-11H2,1H3,(H,17,20).
What are the key properties of 1-[4-(1-cyclopentylethylamino)phenyl]imidazolidin-2-one?
1-[4-(1-cyclopentylethylamino)phenyl]imidazolidin-2-one has a molecular weight of 273.38 g/mol, XLogP of 3.21, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(1-cyclopentylethylamino)phenyl]imidazolidin-2-one is sourced from PubChem (CID 62631563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).