(5R)-1-acetyl-5-[(4-chlorophenyl)methyl]-3-methyl-2-phenylimidazolidin-4-one

C19H19ClN2O2 — CID 59072611

IUPAC(5R)-1-acetyl-5-[(4-chlorophenyl)methyl]-3-methyl-2-phenylimidazolidin-4-one
SMILESCC(=O)N1C(c2ccccc2)N(C)C(=O)[C@H]1Cc1ccc(Cl)cc1
InChIInChI=1S/C19H19ClN2O2/c1-13(23)22-17(12-14-8-10-16(20)11-9-14)19(24)21(2)18(22)15-6-4-3-5-7-15/h3-11,17-18H,12H2,1-2H3/t17-,18?/m1/s1
InChIKeyQDXBZDBQJOWBAU-QNSVNVJESA-N
MW342.83 g/mol
LogP3.27
Rot. Bonds3

About (5R)-1-acetyl-5-[(4-chlorophenyl)methyl]-3-methyl-2-phenylimidazolidin-4-one

(5R)-1-acetyl-5-[(4-chlorophenyl)methyl]-3-methyl-2-phenylimidazolidin-4-one (PubChem CID 59072611) has the molecular formula C19H19ClN2O2 and a molecular weight of 342.83 g/mol. Its IUPAC name is (5R)-1-acetyl-5-[(4-chlorophenyl)methyl]-3-methyl-2-phenylimidazolidin-4-one.

Molecular Properties

Compound Name(5R)-1-acetyl-5-[(4-chlorophenyl)methyl]-3-methyl-2-phenylimidazolidin-4-one
PubChem CID59072611
Molecular FormulaC19H19ClN2O2
Molecular Weight342.83 g/mol
Exact Mass342.11
IUPAC Name(5R)-1-acetyl-5-[(4-chlorophenyl)methyl]-3-methyl-2-phenylimidazolidin-4-one
SMILESCC(=O)N1C(c2ccccc2)N(C)C(=O)[C@H]1Cc1ccc(Cl)cc1
InChIInChI=1S/C19H19ClN2O2/c1-13(23)22-17(12-14-8-10-16(20)11-9-14)19(24)21(2)18(22)15-6-4-3-5-7-15/h3-11,17-18H,12H2,1-2H3/t17-,18?/m1/s1
InChIKeyQDXBZDBQJOWBAU-QNSVNVJESA-N
XLogP3.27
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.83
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-acetyl-2-(4-iodophenyl)-5-[(4-methoxyphenyl)methyl]-3-methylimidazolidin-4-one
CID 165011788
1-butanoyl-3-methyl-2-phenyl-5-(pyridin-3-ylmethyl)imidazolidin-4-one
CID 23531195
(2S,5S)-5-benzyl-2-tert-butyl-3-methyl-4-oxoimidazolidine-1-carbonyl chloride
CID 138977927
1,4-diacetyl-3,6-dibenzylpiperazine-2,5-dione
CID 4680633
(2S,5R)-1-benzoyl-5-benzyl-2-tert-butyl-3-methylimidazolidin-4-one
CID 91703996
1-butanoyl-3,5-dimethyl-2-phenylimidazolidin-4-one
CID 23384012
5-benzyl-2-(4-chlorophenyl)-3-methylimidazolidin-4-one
CID 83267520
(7S,9aR)-7-benzyl-2-(4-chlorobenzoyl)-8-methyl-3,4,7,9a-tetrahydro-1H-pyrazino[1,2-a]pyrazine-6,9-dione
CID 56852078
(5R)-1-acetyl-3-methyl-2-(2-phenylethyl)-5-(pyridin-3-ylmethyl)imidazolidin-4-one
CID 59072619
(2R,5S)-5-benzyl-1-(5-chloro-2-nitrobenzoyl)-3-methyl-2-(1-phenylethenyl)imidazolidin-4-one
CID 46192204
4-[[(2R,5S,6R)-5,6-bis(4-chlorophenyl)-4-methyl-3-oxomorpholin-2-yl]methyl]benzamide
CID 90357357
(3aR,4S,7S,7aR)-2-[2-(4-chlorophenyl)ethyl]-4,7-diphenyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione
CID 40899215

Frequently Asked Questions

What is the IUPAC name of (5R)-1-acetyl-5-[(4-chlorophenyl)methyl]-3-methyl-2-phenylimidazolidin-4-one?
The IUPAC name of (5R)-1-acetyl-5-[(4-chlorophenyl)methyl]-3-methyl-2-phenylimidazolidin-4-one (CID 59072611) is (5R)-1-acetyl-5-[(4-chlorophenyl)methyl]-3-methyl-2-phenylimidazolidin-4-one.
What is the SMILES notation for (5R)-1-acetyl-5-[(4-chlorophenyl)methyl]-3-methyl-2-phenylimidazolidin-4-one?
The canonical SMILES for (5R)-1-acetyl-5-[(4-chlorophenyl)methyl]-3-methyl-2-phenylimidazolidin-4-one is CC(=O)N1C(c2ccccc2)N(C)C(=O)[C@H]1Cc1ccc(Cl)cc1.
What is the InChIKey of (5R)-1-acetyl-5-[(4-chlorophenyl)methyl]-3-methyl-2-phenylimidazolidin-4-one?
The InChIKey is QDXBZDBQJOWBAU-QNSVNVJESA-N. The full InChI is InChI=1S/C19H19ClN2O2/c1-13(23)22-17(12-14-8-10-16(20)11-9-14)19(24)21(2)18(22)15-6-4-3-5-7-15/h3-11,17-18H,12H2,1-2H3/t17-,18?/m1/s1.
What are the key properties of (5R)-1-acetyl-5-[(4-chlorophenyl)methyl]-3-methyl-2-phenylimidazolidin-4-one?
(5R)-1-acetyl-5-[(4-chlorophenyl)methyl]-3-methyl-2-phenylimidazolidin-4-one has a molecular weight of 342.83 g/mol, XLogP of 3.27, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-1-acetyl-5-[(4-chlorophenyl)methyl]-3-methyl-2-phenylimidazolidin-4-one is sourced from PubChem (CID 59072611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).