(5R)-5-cyclohexyl-5-methyl-3-[[(3S)-3-(trifluoromethyl)piperidin-1-yl]methyl]imidazolidine-2,4-dione

C17H26F3N3O2 — CID 51887205

IUPAC(5R)-5-cyclohexyl-5-methyl-3-[[(3S)-3-(trifluoromethyl)piperidin-1-yl]methyl]imidazolidine-2,4-dione
SMILESC[C@]1(C2CCCCC2)NC(=O)N(CN2CCC[C@H](C(F)(F)F)C2)C1=O
InChIInChI=1S/C17H26F3N3O2/c1-16(12-6-3-2-4-7-12)14(24)23(15(25)21-16)11-22-9-5-8-13(10-22)17(18,19)20/h12-13H,2-11H2,1H3,(H,21,25)/t13-,16+/m0/s1
InChIKeyQJJYSMFVULXPKO-XJKSGUPXSA-N
MW361.41 g/mol
LogP3.11
Rot. Bonds3

About (5R)-5-cyclohexyl-5-methyl-3-[[(3S)-3-(trifluoromethyl)piperidin-1-yl]methyl]imidazolidine-2,4-dione

(5R)-5-cyclohexyl-5-methyl-3-[[(3S)-3-(trifluoromethyl)piperidin-1-yl]methyl]imidazolidine-2,4-dione (PubChem CID 51887205) has the molecular formula C17H26F3N3O2 and a molecular weight of 361.41 g/mol. Its IUPAC name is (5R)-5-cyclohexyl-5-methyl-3-[[(3S)-3-(trifluoromethyl)piperidin-1-yl]methyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name(5R)-5-cyclohexyl-5-methyl-3-[[(3S)-3-(trifluoromethyl)piperidin-1-yl]methyl]imidazolidine-2,4-dione
PubChem CID51887205
Molecular FormulaC17H26F3N3O2
Molecular Weight361.41 g/mol
Exact Mass361.20
IUPAC Name(5R)-5-cyclohexyl-5-methyl-3-[[(3S)-3-(trifluoromethyl)piperidin-1-yl]methyl]imidazolidine-2,4-dione
SMILESC[C@]1(C2CCCCC2)NC(=O)N(CN2CCC[C@H](C(F)(F)F)C2)C1=O
InChIInChI=1S/C17H26F3N3O2/c1-16(12-6-3-2-4-7-12)14(24)23(15(25)21-16)11-22-9-5-8-13(10-22)17(18,19)20/h12-13H,2-11H2,1H3,(H,21,25)/t13-,16+/m0/s1
InChIKeyQJJYSMFVULXPKO-XJKSGUPXSA-N
XLogP3.11
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.41
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze (5R)-5-cyclohexyl-5-methyl-3-[[(3S)-3-(trifluoromethyl)piperidin-1-yl]methyl]imidazolidine-2,4-dione with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (5R)-5-cyclohexyl-5-methyl-3-[[(3S)-3-(trifluoromethyl)piperidin-1-yl]methyl]imidazolidine-2,4-dione?
The IUPAC name of (5R)-5-cyclohexyl-5-methyl-3-[[(3S)-3-(trifluoromethyl)piperidin-1-yl]methyl]imidazolidine-2,4-dione (CID 51887205) is (5R)-5-cyclohexyl-5-methyl-3-[[(3S)-3-(trifluoromethyl)piperidin-1-yl]methyl]imidazolidine-2,4-dione.
What is the SMILES notation for (5R)-5-cyclohexyl-5-methyl-3-[[(3S)-3-(trifluoromethyl)piperidin-1-yl]methyl]imidazolidine-2,4-dione?
The canonical SMILES for (5R)-5-cyclohexyl-5-methyl-3-[[(3S)-3-(trifluoromethyl)piperidin-1-yl]methyl]imidazolidine-2,4-dione is C[C@]1(C2CCCCC2)NC(=O)N(CN2CCC[C@H](C(F)(F)F)C2)C1=O.
What is the InChIKey of (5R)-5-cyclohexyl-5-methyl-3-[[(3S)-3-(trifluoromethyl)piperidin-1-yl]methyl]imidazolidine-2,4-dione?
The InChIKey is QJJYSMFVULXPKO-XJKSGUPXSA-N. The full InChI is InChI=1S/C17H26F3N3O2/c1-16(12-6-3-2-4-7-12)14(24)23(15(25)21-16)11-22-9-5-8-13(10-22)17(18,19)20/h12-13H,2-11H2,1H3,(H,21,25)/t13-,16+/m0/s1.
What are the key properties of (5R)-5-cyclohexyl-5-methyl-3-[[(3S)-3-(trifluoromethyl)piperidin-1-yl]methyl]imidazolidine-2,4-dione?
(5R)-5-cyclohexyl-5-methyl-3-[[(3S)-3-(trifluoromethyl)piperidin-1-yl]methyl]imidazolidine-2,4-dione has a molecular weight of 361.41 g/mol, XLogP of 3.11, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-cyclohexyl-5-methyl-3-[[(3S)-3-(trifluoromethyl)piperidin-1-yl]methyl]imidazolidine-2,4-dione is sourced from PubChem (CID 51887205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).