1-[2-[[(1R)-1-(2-chlorophenyl)ethyl]-cyclopropylamino]acetyl]imidazolidin-2-one

C16H20ClN3O2 — CID 94531068

IUPAC1-[2-[[(1R)-1-(2-chlorophenyl)ethyl]-cyclopropylamino]acetyl]imidazolidin-2-one
SMILESC[C@H](c1ccccc1Cl)N(CC(=O)N1CCNC1=O)C1CC1
InChIInChI=1S/C16H20ClN3O2/c1-11(13-4-2-3-5-14(13)17)20(12-6-7-12)10-15(21)19-9-8-18-16(19)22/h2-5,11-12H,6-10H2,1H3,(H,18,22)/t11-/m1/s1
InChIKeyDTEKNYZVOLXLBF-LLVKDONJSA-N
MW321.81 g/mol
LogP2.42
Rot. Bonds5

About 1-[2-[[(1R)-1-(2-chlorophenyl)ethyl]-cyclopropylamino]acetyl]imidazolidin-2-one

1-[2-[[(1R)-1-(2-chlorophenyl)ethyl]-cyclopropylamino]acetyl]imidazolidin-2-one (PubChem CID 94531068) has the molecular formula C16H20ClN3O2 and a molecular weight of 321.81 g/mol. Its IUPAC name is 1-[2-[[(1R)-1-(2-chlorophenyl)ethyl]-cyclopropylamino]acetyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[2-[[(1R)-1-(2-chlorophenyl)ethyl]-cyclopropylamino]acetyl]imidazolidin-2-one
PubChem CID94531068
Molecular FormulaC16H20ClN3O2
Molecular Weight321.81 g/mol
Exact Mass321.12
IUPAC Name1-[2-[[(1R)-1-(2-chlorophenyl)ethyl]-cyclopropylamino]acetyl]imidazolidin-2-one
SMILESC[C@H](c1ccccc1Cl)N(CC(=O)N1CCNC1=O)C1CC1
InChIInChI=1S/C16H20ClN3O2/c1-11(13-4-2-3-5-14(13)17)20(12-6-7-12)10-15(21)19-9-8-18-16(19)22/h2-5,11-12H,6-10H2,1H3,(H,18,22)/t11-/m1/s1
InChIKeyDTEKNYZVOLXLBF-LLVKDONJSA-N
XLogP2.42
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.81
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-acetylpiperidin-4-yl)-2-[1-(2-chlorophenyl)ethyl-cyclopropylamino]acetamide
CID 60523581
(2-chlorophenyl)methyl-methyl-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]azanium
CID 9057785
1-[2-[1-(2,5-difluorophenyl)ethyl-methylamino]acetyl]imidazolidin-2-one
CID 56815809
2-[[(1R)-1-(2-chlorophenyl)ethyl]-cyclopropylamino]-N-(2-nitrophenyl)acetamide
CID 51961221
2-[[(1S)-1-(2-chlorophenyl)ethyl]-cyclopropylamino]-N-(2-nitrophenyl)acetamide
CID 51961219
1-[1-(2-chlorophenyl)ethyl]imidazolidin-2-one
CID 115370564
2-[1-(2-chlorophenyl)ethyl-cyclopropylamino]-N-cyclopentyl-N-(1,1-dioxothiolan-3-yl)acetamide
CID 60523416
2-[1-[1-(2-chlorophenyl)ethyl]-3-oxopiperazin-2-yl]acetic acid
CID 65071303
2-[1-(2-bromophenyl)ethyl-cyclopropylamino]acetic acid
CID 65057476
1-[2-[benzyl(1-pyridin-2-ylethyl)amino]acetyl]imidazolidin-2-one
CID 84597256
1-[(2S)-2-[(2-chlorophenyl)methylsulfanyl]propanoyl]imidazolidin-2-one
CID 99825904
1-(azepan-1-yl)-2-[1-(2-chlorophenyl)ethyl-methylamino]ethanone
CID 60505189

Frequently Asked Questions

What is the IUPAC name of 1-[2-[[(1R)-1-(2-chlorophenyl)ethyl]-cyclopropylamino]acetyl]imidazolidin-2-one?
The IUPAC name of 1-[2-[[(1R)-1-(2-chlorophenyl)ethyl]-cyclopropylamino]acetyl]imidazolidin-2-one (CID 94531068) is 1-[2-[[(1R)-1-(2-chlorophenyl)ethyl]-cyclopropylamino]acetyl]imidazolidin-2-one.
What is the SMILES notation for 1-[2-[[(1R)-1-(2-chlorophenyl)ethyl]-cyclopropylamino]acetyl]imidazolidin-2-one?
The canonical SMILES for 1-[2-[[(1R)-1-(2-chlorophenyl)ethyl]-cyclopropylamino]acetyl]imidazolidin-2-one is C[C@H](c1ccccc1Cl)N(CC(=O)N1CCNC1=O)C1CC1.
What is the InChIKey of 1-[2-[[(1R)-1-(2-chlorophenyl)ethyl]-cyclopropylamino]acetyl]imidazolidin-2-one?
The InChIKey is DTEKNYZVOLXLBF-LLVKDONJSA-N. The full InChI is InChI=1S/C16H20ClN3O2/c1-11(13-4-2-3-5-14(13)17)20(12-6-7-12)10-15(21)19-9-8-18-16(19)22/h2-5,11-12H,6-10H2,1H3,(H,18,22)/t11-/m1/s1.
What are the key properties of 1-[2-[[(1R)-1-(2-chlorophenyl)ethyl]-cyclopropylamino]acetyl]imidazolidin-2-one?
1-[2-[[(1R)-1-(2-chlorophenyl)ethyl]-cyclopropylamino]acetyl]imidazolidin-2-one has a molecular weight of 321.81 g/mol, XLogP of 2.42, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[[(1R)-1-(2-chlorophenyl)ethyl]-cyclopropylamino]acetyl]imidazolidin-2-one is sourced from PubChem (CID 94531068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).