(4R,5R)-1-methyl-4,5-diphenyl-3-propanoylimidazolidin-2-one

C19H20N2O2 — CID 14905101

IUPAC(4R,5R)-1-methyl-4,5-diphenyl-3-propanoylimidazolidin-2-one
SMILESCCC(=O)N1C(=O)N(C)[C@H](c2ccccc2)[C@H]1c1ccccc1
InChIInChI=1S/C19H20N2O2/c1-3-16(22)21-18(15-12-8-5-9-13-15)17(20(2)19(21)23)14-10-6-4-7-11-14/h4-13,17-18H,3H2,1-2H3/t17-,18-/m1/s1
InChIKeyFSQZJLRTBDRGNV-QZTJIDSGSA-N
MW308.38 g/mol
LogP3.77
Rot. Bonds3

About (4R,5R)-1-methyl-4,5-diphenyl-3-propanoylimidazolidin-2-one

(4R,5R)-1-methyl-4,5-diphenyl-3-propanoylimidazolidin-2-one (PubChem CID 14905101) has the molecular formula C19H20N2O2 and a molecular weight of 308.38 g/mol. Its IUPAC name is (4R,5R)-1-methyl-4,5-diphenyl-3-propanoylimidazolidin-2-one.

Molecular Properties

Compound Name(4R,5R)-1-methyl-4,5-diphenyl-3-propanoylimidazolidin-2-one
PubChem CID14905101
Molecular FormulaC19H20N2O2
Molecular Weight308.38 g/mol
Exact Mass308.15
IUPAC Name(4R,5R)-1-methyl-4,5-diphenyl-3-propanoylimidazolidin-2-one
SMILESCCC(=O)N1C(=O)N(C)[C@H](c2ccccc2)[C@H]1c1ccccc1
InChIInChI=1S/C19H20N2O2/c1-3-16(22)21-18(15-12-8-5-9-13-15)17(20(2)19(21)23)14-10-6-4-7-11-14/h4-13,17-18H,3H2,1-2H3/t17-,18-/m1/s1
InChIKeyFSQZJLRTBDRGNV-QZTJIDSGSA-N
XLogP3.77
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(4R,5S)-1,4-dimethyl-5-phenyl-3-propanoylimidazolidin-2-one
CID 59890448
(4S,5S)-1-[(2S)-3,3-dimethoxy-2-methylpropanoyl]-3-methyl-4,5-diphenylimidazolidin-2-one
CID 139725454
N-[2-[(4S,5R)-3,4-dimethyl-2-oxo-5-phenylimidazolidin-1-yl]-2-oxoethyl]-N-formylformamide
CID 101112759
(4R,5S)-1,5-dimethyl-3-[(2S)-2-methylpentanoyl]-4-phenylimidazolidin-2-one
CID 11098197
1-(2,2-dimethylpropanoyl)-3,4-dimethyl-5-phenylimidazolidin-2-one
CID 59519611
[[(4S,5R)-3,4-dimethyl-2-oxo-5-phenylimidazolidin-1-yl]-phenylmethylidene]chromium
CID 10961201
(4S,5R)-1-(2,2-dibromoacetyl)-3,4-dimethyl-5-phenylimidazolidin-2-one
CID 11047406
(4S,5R)-1-(2-bromopropanoyl)-3,4-dimethyl-5-phenylimidazolidin-2-one
CID 11110159
(4R,5S)-1,5-dimethyl-3-[3-(4-methylsulfonylphenyl)-3-phenylpropanoyl]-4-phenylimidazolidin-2-one
CID 69265232
(4S,5R)-1-[(2R)-2-(benzylamino)butanoyl]-3,4-dimethyl-5-phenylimidazolidin-2-one
CID 11024926
(1,3-dimethyl-4,5-diphenylimidazolidin-2-ylidene)azanide
CID 162358368
(4S,5R)-1-buta-2,3-dien-2-yl-3,4-dimethyl-5-phenylimidazolidin-2-one
CID 12061801

Frequently Asked Questions

What is the IUPAC name of (4R,5R)-1-methyl-4,5-diphenyl-3-propanoylimidazolidin-2-one?
The IUPAC name of (4R,5R)-1-methyl-4,5-diphenyl-3-propanoylimidazolidin-2-one (CID 14905101) is (4R,5R)-1-methyl-4,5-diphenyl-3-propanoylimidazolidin-2-one.
What is the SMILES notation for (4R,5R)-1-methyl-4,5-diphenyl-3-propanoylimidazolidin-2-one?
The canonical SMILES for (4R,5R)-1-methyl-4,5-diphenyl-3-propanoylimidazolidin-2-one is CCC(=O)N1C(=O)N(C)[C@H](c2ccccc2)[C@H]1c1ccccc1.
What is the InChIKey of (4R,5R)-1-methyl-4,5-diphenyl-3-propanoylimidazolidin-2-one?
The InChIKey is FSQZJLRTBDRGNV-QZTJIDSGSA-N. The full InChI is InChI=1S/C19H20N2O2/c1-3-16(22)21-18(15-12-8-5-9-13-15)17(20(2)19(21)23)14-10-6-4-7-11-14/h4-13,17-18H,3H2,1-2H3/t17-,18-/m1/s1.
What are the key properties of (4R,5R)-1-methyl-4,5-diphenyl-3-propanoylimidazolidin-2-one?
(4R,5R)-1-methyl-4,5-diphenyl-3-propanoylimidazolidin-2-one has a molecular weight of 308.38 g/mol, XLogP of 3.77, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R,5R)-1-methyl-4,5-diphenyl-3-propanoylimidazolidin-2-one is sourced from PubChem (CID 14905101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).