(5S)-1-[(3-chlorophenyl)methyl]-5-phenylimidazolidin-2-one

C16H15ClN2O — CID 124677204

IUPAC(5S)-1-[(3-chlorophenyl)methyl]-5-phenylimidazolidin-2-one
SMILESO=C1NC[C@H](c2ccccc2)N1Cc1cccc(Cl)c1
InChIInChI=1S/C16H15ClN2O/c17-14-8-4-5-12(9-14)11-19-15(10-18-16(19)20)13-6-2-1-3-7-13/h1-9,15H,10-11H2,(H,18,20)/t15-/m1/s1
InChIKeyZZDYKDCRAQJRRU-OAHLLOKOSA-N
MW286.76 g/mol
LogP3.61
Rot. Bonds3

About (5S)-1-[(3-chlorophenyl)methyl]-5-phenylimidazolidin-2-one

(5S)-1-[(3-chlorophenyl)methyl]-5-phenylimidazolidin-2-one (PubChem CID 124677204) has the molecular formula C16H15ClN2O and a molecular weight of 286.76 g/mol. Its IUPAC name is (5S)-1-[(3-chlorophenyl)methyl]-5-phenylimidazolidin-2-one.

Molecular Properties

Compound Name(5S)-1-[(3-chlorophenyl)methyl]-5-phenylimidazolidin-2-one
PubChem CID124677204
Molecular FormulaC16H15ClN2O
Molecular Weight286.76 g/mol
Exact Mass286.09
IUPAC Name(5S)-1-[(3-chlorophenyl)methyl]-5-phenylimidazolidin-2-one
SMILESO=C1NC[C@H](c2ccccc2)N1Cc1cccc(Cl)c1
InChIInChI=1S/C16H15ClN2O/c17-14-8-4-5-12(9-14)11-19-15(10-18-16(19)20)13-6-2-1-3-7-13/h1-9,15H,10-11H2,(H,18,20)/t15-/m1/s1
InChIKeyZZDYKDCRAQJRRU-OAHLLOKOSA-N
XLogP3.61
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.76
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-[(3-chlorophenyl)methyl]-5-phenylimidazolidine-2-carbaldehyde
CID 174777443
(3S,4R)-2-[(3-chlorophenyl)methyl]-4-hydroxy-3-phenyl-2,9-diazaspiro[5.5]undecan-1-one
CID 110148251
1-benzyl-4-phenylazetidin-2-one;ethane
CID 91301101
1-benzyl-5-pentylimidazolidin-2-one
CID 102031647
[(3S)-1-[(3-chlorophenyl)methyl]-2-oxopyrrolidin-3-yl]azanium chloride
CID 10934236
1-[(3-chlorophenyl)methyl]-3a,4,5,6,7,7a-hexahydro-[1,3]oxazolo[5,4-c]pyridin-2-one
CID 115007169
1-[(3-chlorophenyl)methyl]-6-oxopiperidine-2-carboxylic acid
CID 91812161
1-benzyl-2-phenyl-2,3-dihydroquinolin-4-one
CID 134841606
(3R)-1-benzyl-3-(3-chlorophenyl)pyrrolidine-2,5-dione
CID 53474672
1-[(3-chlorophenyl)methyl]-3,4-dihydroquinazolin-2-one
CID 141040925
1-benzyl-5-prop-2-enylimidazolidin-2-one
CID 13351723
2-[3-[(3-chlorophenyl)methyl]-2-oxo-1,3-oxazolidin-4-yl]acetic acid
CID 115060184

Frequently Asked Questions

What is the IUPAC name of (5S)-1-[(3-chlorophenyl)methyl]-5-phenylimidazolidin-2-one?
The IUPAC name of (5S)-1-[(3-chlorophenyl)methyl]-5-phenylimidazolidin-2-one (CID 124677204) is (5S)-1-[(3-chlorophenyl)methyl]-5-phenylimidazolidin-2-one.
What is the SMILES notation for (5S)-1-[(3-chlorophenyl)methyl]-5-phenylimidazolidin-2-one?
The canonical SMILES for (5S)-1-[(3-chlorophenyl)methyl]-5-phenylimidazolidin-2-one is O=C1NC[C@H](c2ccccc2)N1Cc1cccc(Cl)c1.
What is the InChIKey of (5S)-1-[(3-chlorophenyl)methyl]-5-phenylimidazolidin-2-one?
The InChIKey is ZZDYKDCRAQJRRU-OAHLLOKOSA-N. The full InChI is InChI=1S/C16H15ClN2O/c17-14-8-4-5-12(9-14)11-19-15(10-18-16(19)20)13-6-2-1-3-7-13/h1-9,15H,10-11H2,(H,18,20)/t15-/m1/s1.
What are the key properties of (5S)-1-[(3-chlorophenyl)methyl]-5-phenylimidazolidin-2-one?
(5S)-1-[(3-chlorophenyl)methyl]-5-phenylimidazolidin-2-one has a molecular weight of 286.76 g/mol, XLogP of 3.61, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-1-[(3-chlorophenyl)methyl]-5-phenylimidazolidin-2-one is sourced from PubChem (CID 124677204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).