(5S)-5-cyclohexyl-5-methyl-3-[(E)-3-phenylprop-2-enyl]imidazolidine-2,4-dione

C19H24N2O2 — CID 7618939

IUPAC(5S)-5-cyclohexyl-5-methyl-3-[(E)-3-phenylprop-2-enyl]imidazolidine-2,4-dione
SMILESC[C@@]1(C2CCCCC2)NC(=O)N(C/C=C/c2ccccc2)C1=O
InChIInChI=1S/C19H24N2O2/c1-19(16-12-6-3-7-13-16)17(22)21(18(23)20-19)14-8-11-15-9-4-2-5-10-15/h2,4-5,8-11,16H,3,6-7,12-14H2,1H3,(H,20,23)/b11-8+/t19-/m0/s1
InChIKeyRSCPAGWUVVRGJR-BLRBJFNZSA-N
MW312.41 g/mol
LogP3.59
Rot. Bonds4

About (5S)-5-cyclohexyl-5-methyl-3-[(E)-3-phenylprop-2-enyl]imidazolidine-2,4-dione

(5S)-5-cyclohexyl-5-methyl-3-[(E)-3-phenylprop-2-enyl]imidazolidine-2,4-dione (PubChem CID 7618939) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is (5S)-5-cyclohexyl-5-methyl-3-[(E)-3-phenylprop-2-enyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name(5S)-5-cyclohexyl-5-methyl-3-[(E)-3-phenylprop-2-enyl]imidazolidine-2,4-dione
PubChem CID7618939
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC Name(5S)-5-cyclohexyl-5-methyl-3-[(E)-3-phenylprop-2-enyl]imidazolidine-2,4-dione
SMILESC[C@@]1(C2CCCCC2)NC(=O)N(C/C=C/c2ccccc2)C1=O
InChIInChI=1S/C19H24N2O2/c1-19(16-12-6-3-7-13-16)17(22)21(18(23)20-19)14-8-11-15-9-4-2-5-10-15/h2,4-5,8-11,16H,3,6-7,12-14H2,1H3,(H,20,23)/b11-8+/t19-/m0/s1
InChIKeyRSCPAGWUVVRGJR-BLRBJFNZSA-N
XLogP3.59
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (5S)-5-cyclohexyl-5-methyl-3-[(E)-3-phenylprop-2-enyl]imidazolidine-2,4-dione?
The IUPAC name of (5S)-5-cyclohexyl-5-methyl-3-[(E)-3-phenylprop-2-enyl]imidazolidine-2,4-dione (CID 7618939) is (5S)-5-cyclohexyl-5-methyl-3-[(E)-3-phenylprop-2-enyl]imidazolidine-2,4-dione.
What is the SMILES notation for (5S)-5-cyclohexyl-5-methyl-3-[(E)-3-phenylprop-2-enyl]imidazolidine-2,4-dione?
The canonical SMILES for (5S)-5-cyclohexyl-5-methyl-3-[(E)-3-phenylprop-2-enyl]imidazolidine-2,4-dione is C[C@@]1(C2CCCCC2)NC(=O)N(C/C=C/c2ccccc2)C1=O.
What is the InChIKey of (5S)-5-cyclohexyl-5-methyl-3-[(E)-3-phenylprop-2-enyl]imidazolidine-2,4-dione?
The InChIKey is RSCPAGWUVVRGJR-BLRBJFNZSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-19(16-12-6-3-7-13-16)17(22)21(18(23)20-19)14-8-11-15-9-4-2-5-10-15/h2,4-5,8-11,16H,3,6-7,12-14H2,1H3,(H,20,23)/b11-8+/t19-/m0/s1.
What are the key properties of (5S)-5-cyclohexyl-5-methyl-3-[(E)-3-phenylprop-2-enyl]imidazolidine-2,4-dione?
(5S)-5-cyclohexyl-5-methyl-3-[(E)-3-phenylprop-2-enyl]imidazolidine-2,4-dione has a molecular weight of 312.41 g/mol, XLogP of 3.59, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-5-cyclohexyl-5-methyl-3-[(E)-3-phenylprop-2-enyl]imidazolidine-2,4-dione is sourced from PubChem (CID 7618939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).