(5R)-5-methyl-5-(2-methylpropyl)-3-(2-pyridin-4-ylethyl)imidazolidine-2,4-dione

C15H21N3O2 — CID 95597576

IUPAC(5R)-5-methyl-5-(2-methylpropyl)-3-(2-pyridin-4-ylethyl)imidazolidine-2,4-dione
SMILESCC(C)C[C@@]1(C)NC(=O)N(CCc2ccncc2)C1=O
InChIInChI=1S/C15H21N3O2/c1-11(2)10-15(3)13(19)18(14(20)17-15)9-6-12-4-7-16-8-5-12/h4-5,7-8,11H,6,9-10H2,1-3H3,(H,17,20)/t15-/m1/s1
InChIKeyBUZOVUFDCFGWKX-OAHLLOKOSA-N
MW275.35 g/mol
LogP1.98
Rot. Bonds5

About (5R)-5-methyl-5-(2-methylpropyl)-3-(2-pyridin-4-ylethyl)imidazolidine-2,4-dione

(5R)-5-methyl-5-(2-methylpropyl)-3-(2-pyridin-4-ylethyl)imidazolidine-2,4-dione (PubChem CID 95597576) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is (5R)-5-methyl-5-(2-methylpropyl)-3-(2-pyridin-4-ylethyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name(5R)-5-methyl-5-(2-methylpropyl)-3-(2-pyridin-4-ylethyl)imidazolidine-2,4-dione
PubChem CID95597576
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC Name(5R)-5-methyl-5-(2-methylpropyl)-3-(2-pyridin-4-ylethyl)imidazolidine-2,4-dione
SMILESCC(C)C[C@@]1(C)NC(=O)N(CCc2ccncc2)C1=O
InChIInChI=1S/C15H21N3O2/c1-11(2)10-15(3)13(19)18(14(20)17-15)9-6-12-4-7-16-8-5-12/h4-5,7-8,11H,6,9-10H2,1-3H3,(H,17,20)/t15-/m1/s1
InChIKeyBUZOVUFDCFGWKX-OAHLLOKOSA-N
XLogP1.98
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze (5R)-5-methyl-5-(2-methylpropyl)-3-(2-pyridin-4-ylethyl)imidazolidine-2,4-dione with MolForge

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Related Compounds

2-[2-[(4S)-4-methyl-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]ethyl]isoindole-1,3-dione
CID 2583395
5-methyl-3-(2-phenylethyl)-5-pyridin-4-ylimidazolidine-2,4-dione
CID 110226505
5-(4-tert-butylphenyl)-5-methyl-3-(2-pyridin-4-ylethyl)imidazolidine-2,4-dione
CID 75858248
7-(2-pyridin-4-ylethyl)-5,7-diazaspiro[2.5]octane-4,6,8-trione
CID 112599586
2-[4-(2-methylpropyl)-2,5-dioxo-1-(2-phenylethyl)imidazolidin-4-yl]acetic acid
CID 19705480
N,N-dimethyl-4-[[4-methyl-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]methyl]benzamide
CID 84601226
N-benzyl-2-[4-methyl-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]acetamide
CID 51138882
(5R)-3-[2-(4-chlorophenyl)-2-oxoethyl]-5-methyl-5-(2-methylpropyl)imidazolidine-2,4-dione
CID 2711199
3-(2,2-diethoxyethyl)-5-methyl-5-(2-methylpropyl)imidazolidine-2,4-dione
CID 75511262
(5R)-5-(2-methylpropyl)-5-[1-(pyridin-4-ylmethyl)piperidin-4-yl]-3-(2-thiophen-2-ylethyl)imidazolidine-2,4-dione
CID 42440096
3-[(3-benzyl-1,2,4-oxadiazol-5-yl)methyl]-5-methyl-5-(2-methylpropyl)imidazolidine-2,4-dione
CID 56812667
3-cyclopropyl-3-methyl-1-(2-pyridin-4-ylethyl)piperazine-2,5-dione
CID 64964160

Frequently Asked Questions

What is the IUPAC name of (5R)-5-methyl-5-(2-methylpropyl)-3-(2-pyridin-4-ylethyl)imidazolidine-2,4-dione?
The IUPAC name of (5R)-5-methyl-5-(2-methylpropyl)-3-(2-pyridin-4-ylethyl)imidazolidine-2,4-dione (CID 95597576) is (5R)-5-methyl-5-(2-methylpropyl)-3-(2-pyridin-4-ylethyl)imidazolidine-2,4-dione.
What is the SMILES notation for (5R)-5-methyl-5-(2-methylpropyl)-3-(2-pyridin-4-ylethyl)imidazolidine-2,4-dione?
The canonical SMILES for (5R)-5-methyl-5-(2-methylpropyl)-3-(2-pyridin-4-ylethyl)imidazolidine-2,4-dione is CC(C)C[C@@]1(C)NC(=O)N(CCc2ccncc2)C1=O.
What is the InChIKey of (5R)-5-methyl-5-(2-methylpropyl)-3-(2-pyridin-4-ylethyl)imidazolidine-2,4-dione?
The InChIKey is BUZOVUFDCFGWKX-OAHLLOKOSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-11(2)10-15(3)13(19)18(14(20)17-15)9-6-12-4-7-16-8-5-12/h4-5,7-8,11H,6,9-10H2,1-3H3,(H,17,20)/t15-/m1/s1.
What are the key properties of (5R)-5-methyl-5-(2-methylpropyl)-3-(2-pyridin-4-ylethyl)imidazolidine-2,4-dione?
(5R)-5-methyl-5-(2-methylpropyl)-3-(2-pyridin-4-ylethyl)imidazolidine-2,4-dione has a molecular weight of 275.35 g/mol, XLogP of 1.98, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-methyl-5-(2-methylpropyl)-3-(2-pyridin-4-ylethyl)imidazolidine-2,4-dione is sourced from PubChem (CID 95597576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).