N-[3-[3-(4-chlorophenyl)-2-oxoimidazolidin-1-yl]-1-bicyclo[1.1.1]pentanyl]acetamide

C16H18ClN3O2 — CID 155093034

IUPACN-[3-[3-(4-chlorophenyl)-2-oxoimidazolidin-1-yl]-1-bicyclo[1.1.1]pentanyl]acetamide
SMILESCC(=O)NC12CC(N3CCN(c4ccc(Cl)cc4)C3=O)(C1)C2
InChIInChI=1S/C16H18ClN3O2/c1-11(21)18-15-8-16(9-15,10-15)20-7-6-19(14(20)22)13-4-2-12(17)3-5-13/h2-5H,6-10H2,1H3,(H,18,21)
InChIKeyOCEWTKNOQUPXMJ-UHFFFAOYSA-N
MW319.79 g/mol
LogP2.39
Rot. Bonds3

About N-[3-[3-(4-chlorophenyl)-2-oxoimidazolidin-1-yl]-1-bicyclo[1.1.1]pentanyl]acetamide

N-[3-[3-(4-chlorophenyl)-2-oxoimidazolidin-1-yl]-1-bicyclo[1.1.1]pentanyl]acetamide (PubChem CID 155093034) has the molecular formula C16H18ClN3O2 and a molecular weight of 319.79 g/mol. Its IUPAC name is N-[3-[3-(4-chlorophenyl)-2-oxoimidazolidin-1-yl]-1-bicyclo[1.1.1]pentanyl]acetamide.

Molecular Properties

Compound NameN-[3-[3-(4-chlorophenyl)-2-oxoimidazolidin-1-yl]-1-bicyclo[1.1.1]pentanyl]acetamide
PubChem CID155093034
Molecular FormulaC16H18ClN3O2
Molecular Weight319.79 g/mol
Exact Mass319.11
IUPAC NameN-[3-[3-(4-chlorophenyl)-2-oxoimidazolidin-1-yl]-1-bicyclo[1.1.1]pentanyl]acetamide
SMILESCC(=O)NC12CC(N3CCN(c4ccc(Cl)cc4)C3=O)(C1)C2
InChIInChI=1S/C16H18ClN3O2/c1-11(21)18-15-8-16(9-15,10-15)20-7-6-19(14(20)22)13-4-2-12(17)3-5-13/h2-5H,6-10H2,1H3,(H,18,21)
InChIKeyOCEWTKNOQUPXMJ-UHFFFAOYSA-N
XLogP2.39
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.79
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[3-[3-(4-chlorophenyl)-2-oxoimidazolidin-1-yl]-1-bicyclo[1.1.1]pentanyl]acetamide?
The IUPAC name of N-[3-[3-(4-chlorophenyl)-2-oxoimidazolidin-1-yl]-1-bicyclo[1.1.1]pentanyl]acetamide (CID 155093034) is N-[3-[3-(4-chlorophenyl)-2-oxoimidazolidin-1-yl]-1-bicyclo[1.1.1]pentanyl]acetamide.
What is the SMILES notation for N-[3-[3-(4-chlorophenyl)-2-oxoimidazolidin-1-yl]-1-bicyclo[1.1.1]pentanyl]acetamide?
The canonical SMILES for N-[3-[3-(4-chlorophenyl)-2-oxoimidazolidin-1-yl]-1-bicyclo[1.1.1]pentanyl]acetamide is CC(=O)NC12CC(N3CCN(c4ccc(Cl)cc4)C3=O)(C1)C2.
What is the InChIKey of N-[3-[3-(4-chlorophenyl)-2-oxoimidazolidin-1-yl]-1-bicyclo[1.1.1]pentanyl]acetamide?
The InChIKey is OCEWTKNOQUPXMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18ClN3O2/c1-11(21)18-15-8-16(9-15,10-15)20-7-6-19(14(20)22)13-4-2-12(17)3-5-13/h2-5H,6-10H2,1H3,(H,18,21).
What are the key properties of N-[3-[3-(4-chlorophenyl)-2-oxoimidazolidin-1-yl]-1-bicyclo[1.1.1]pentanyl]acetamide?
N-[3-[3-(4-chlorophenyl)-2-oxoimidazolidin-1-yl]-1-bicyclo[1.1.1]pentanyl]acetamide has a molecular weight of 319.79 g/mol, XLogP of 2.39, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[3-(4-chlorophenyl)-2-oxoimidazolidin-1-yl]-1-bicyclo[1.1.1]pentanyl]acetamide is sourced from PubChem (CID 155093034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).