[[(4S,5R)-3,4-dimethyl-2-oxo-5-phenylimidazolidin-1-yl]-phenylmethylidene]chromium

C18H18CrN2O — CID 10961201

IUPAC[[(4S,5R)-3,4-dimethyl-2-oxo-5-phenylimidazolidin-1-yl]-phenylmethylidene]chromium
SMILESC[C@H]1[C@@H](c2ccccc2)N(C(=[Cr])c2ccccc2)C(=O)N1C
InChIInChI=1S/C18H18N2O.Cr/c1-14-17(16-11-7-4-8-12-16)20(18(21)19(14)2)13-15-9-5-3-6-10-15;/h3-12,14,17H,1-2H3;/t14-,17-;/m0./s1
InChIKeyKRXONVDRJVIRLN-RVXRQPKJSA-N
MW330.35 g/mol
LogP3.21
Rot. Bonds3

About [[(4S,5R)-3,4-dimethyl-2-oxo-5-phenylimidazolidin-1-yl]-phenylmethylidene]chromium

[[(4S,5R)-3,4-dimethyl-2-oxo-5-phenylimidazolidin-1-yl]-phenylmethylidene]chromium (PubChem CID 10961201) has the molecular formula C18H18CrN2O and a molecular weight of 330.35 g/mol. Its IUPAC name is [[(4S,5R)-3,4-dimethyl-2-oxo-5-phenylimidazolidin-1-yl]-phenylmethylidene]chromium.

Molecular Properties

Compound Name[[(4S,5R)-3,4-dimethyl-2-oxo-5-phenylimidazolidin-1-yl]-phenylmethylidene]chromium
PubChem CID10961201
Molecular FormulaC18H18CrN2O
Molecular Weight330.35 g/mol
Exact Mass330.08
IUPAC Name[[(4S,5R)-3,4-dimethyl-2-oxo-5-phenylimidazolidin-1-yl]-phenylmethylidene]chromium
SMILESC[C@H]1[C@@H](c2ccccc2)N(C(=[Cr])c2ccccc2)C(=O)N1C
InChIInChI=1S/C18H18N2O.Cr/c1-14-17(16-11-7-4-8-12-16)20(18(21)19(14)2)13-15-9-5-3-6-10-15;/h3-12,14,17H,1-2H3;/t14-,17-;/m0./s1
InChIKeyKRXONVDRJVIRLN-RVXRQPKJSA-N
XLogP3.21
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.35
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2,2-dimethylpropanoyl)-3,4-dimethyl-5-phenylimidazolidin-2-one
CID 59519611
(4S,5R)-1-(2,2-dibromoacetyl)-3,4-dimethyl-5-phenylimidazolidin-2-one
CID 11047406
(4S,5R)-1-buta-2,3-dien-2-yl-3,4-dimethyl-5-phenylimidazolidin-2-one
CID 12061801
(4S,5R)-1-(2-bromopropanoyl)-3,4-dimethyl-5-phenylimidazolidin-2-one
CID 11110159
N-[2-[(4S,5R)-3,4-dimethyl-2-oxo-5-phenylimidazolidin-1-yl]-2-oxoethyl]-N-formylformamide
CID 101112759
(4S,5R)-1,5-dimethyl-3-[(E)-4-methylpent-2-enoyl]-4-phenylimidazolidin-2-one
CID 11087392
(4R,5S)-1,4-dimethyl-5-phenyl-3-propanoylimidazolidin-2-one
CID 59890448
(4R,5S)-1,5-dimethyl-3-[(2S)-2-methylpentanoyl]-4-phenylimidazolidin-2-one
CID 11098197
(4S,5R)-1,5-dimethyl-4-phenyl-3-[(3R)-1,2,3,4-tetrahydroisoquinoline-3-carbonyl]imidazolidin-2-one
CID 10712775
(4S,5R)-1-[(2S)-2-amino-5-methylhex-4-enoyl]-3,4-dimethyl-5-phenylimidazolidin-2-one
CID 10686826
1,5-dimethyl-4-phenyl-3-propan-2-ylimidazolidin-2-one
CID 20685332
(4S,5R)-1-[(2S)-2-bromo-4-phenylbutanoyl]-3,4-dimethyl-5-phenylimidazolidin-2-one
CID 139179430

Frequently Asked Questions

What is the IUPAC name of [[(4S,5R)-3,4-dimethyl-2-oxo-5-phenylimidazolidin-1-yl]-phenylmethylidene]chromium?
The IUPAC name of [[(4S,5R)-3,4-dimethyl-2-oxo-5-phenylimidazolidin-1-yl]-phenylmethylidene]chromium (CID 10961201) is [[(4S,5R)-3,4-dimethyl-2-oxo-5-phenylimidazolidin-1-yl]-phenylmethylidene]chromium.
What is the SMILES notation for [[(4S,5R)-3,4-dimethyl-2-oxo-5-phenylimidazolidin-1-yl]-phenylmethylidene]chromium?
The canonical SMILES for [[(4S,5R)-3,4-dimethyl-2-oxo-5-phenylimidazolidin-1-yl]-phenylmethylidene]chromium is C[C@H]1[C@@H](c2ccccc2)N(C(=[Cr])c2ccccc2)C(=O)N1C.
What is the InChIKey of [[(4S,5R)-3,4-dimethyl-2-oxo-5-phenylimidazolidin-1-yl]-phenylmethylidene]chromium?
The InChIKey is KRXONVDRJVIRLN-RVXRQPKJSA-N. The full InChI is InChI=1S/C18H18N2O.Cr/c1-14-17(16-11-7-4-8-12-16)20(18(21)19(14)2)13-15-9-5-3-6-10-15;/h3-12,14,17H,1-2H3;/t14-,17-;/m0./s1.
What are the key properties of [[(4S,5R)-3,4-dimethyl-2-oxo-5-phenylimidazolidin-1-yl]-phenylmethylidene]chromium?
[[(4S,5R)-3,4-dimethyl-2-oxo-5-phenylimidazolidin-1-yl]-phenylmethylidene]chromium has a molecular weight of 330.35 g/mol, XLogP of 3.21, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [[(4S,5R)-3,4-dimethyl-2-oxo-5-phenylimidazolidin-1-yl]-phenylmethylidene]chromium is sourced from PubChem (CID 10961201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).