(5R)-5-ethyl-5-methyl-3-[6-[[(3S)-3-methyl-3,4-dihydro-2H-chromen-5-yl]oxy]-3-pyridinyl]imidazolidine-2,4-dione

C21H23N3O4 — CID 152700236

IUPAC(5R)-5-ethyl-5-methyl-3-[6-[[(3S)-3-methyl-3,4-dihydro-2H-chromen-5-yl]oxy]-3-pyridinyl]imidazolidine-2,4-dione
SMILESCC[C@@]1(C)NC(=O)N(c2ccc(Oc3cccc4c3C[C@H](C)CO4)nc2)C1=O
InChIInChI=1S/C21H23N3O4/c1-4-21(3)19(25)24(20(26)23-21)14-8-9-18(22-11-14)28-17-7-5-6-16-15(17)10-13(2)12-27-16/h5-9,11,13H,4,10,12H2,1-3H3,(H,23,26)/t13-,21+/m0/s1
InChIKeyZRKOWATVZZCKMN-YEJXKQKISA-N
MW381.43 g/mol
LogP3.67
Rot. Bonds4

About (5R)-5-ethyl-5-methyl-3-[6-[[(3S)-3-methyl-3,4-dihydro-2H-chromen-5-yl]oxy]-3-pyridinyl]imidazolidine-2,4-dione

(5R)-5-ethyl-5-methyl-3-[6-[[(3S)-3-methyl-3,4-dihydro-2H-chromen-5-yl]oxy]-3-pyridinyl]imidazolidine-2,4-dione (PubChem CID 152700236) has the molecular formula C21H23N3O4 and a molecular weight of 381.43 g/mol. Its IUPAC name is (5R)-5-ethyl-5-methyl-3-[6-[[(3S)-3-methyl-3,4-dihydro-2H-chromen-5-yl]oxy]-3-pyridinyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name(5R)-5-ethyl-5-methyl-3-[6-[[(3S)-3-methyl-3,4-dihydro-2H-chromen-5-yl]oxy]-3-pyridinyl]imidazolidine-2,4-dione
PubChem CID152700236
Molecular FormulaC21H23N3O4
Molecular Weight381.43 g/mol
Exact Mass381.17
IUPAC Name(5R)-5-ethyl-5-methyl-3-[6-[[(3S)-3-methyl-3,4-dihydro-2H-chromen-5-yl]oxy]-3-pyridinyl]imidazolidine-2,4-dione
SMILESCC[C@@]1(C)NC(=O)N(c2ccc(Oc3cccc4c3C[C@H](C)CO4)nc2)C1=O
InChIInChI=1S/C21H23N3O4/c1-4-21(3)19(25)24(20(26)23-21)14-8-9-18(22-11-14)28-17-7-5-6-16-15(17)10-13(2)12-27-16/h5-9,11,13H,4,10,12H2,1-3H3,(H,23,26)/t13-,21+/m0/s1
InChIKeyZRKOWATVZZCKMN-YEJXKQKISA-N
XLogP3.67
TPSA80.76 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.43
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze (5R)-5-ethyl-5-methyl-3-[6-[[(3S)-3-methyl-3,4-dihydro-2H-chromen-5-yl]oxy]-3-pyridinyl]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

Related Compounds

(5R)-3-[6-[(3,3-dimethyl-1,4-dihydroisochromen-5-yl)oxy]-3-pyridinyl]-5-ethyl-5-methylimidazolidine-2,4-dione
CID 57411183
(5R)-3-[6-[(3,3-dimethyl-1H-2-benzofuran-4-yl)oxy]-3-pyridinyl]-5-ethyl-5-methylimidazolidine-2,4-dione
CID 57411186
(5R)-3-[6-[(3,4-dimethyl-3,4-dihydro-2H-chromen-5-yl)oxy]-3-pyridinyl]-5-iodo-5-methylimidazolidine-2,4-dione
CID 67966851
3-[6-[(3,3-dimethyl-2H-1-benzofuran-4-yl)oxy]-3-pyridinyl]-5,5-dimethylimidazolidine-2,4-dione
CID 57410331
5,5-dimethyl-3-[6-[(4-methyl-3,4-dihydro-2H-chromen-5-yl)oxy]-3-pyridinyl]imidazolidine-2,4-dione
CID 158408774
3-cyclopropyl-4-[[5-[(4R)-4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl]-2-pyridinyl]oxy]benzonitrile
CID 53241113
3-[6-[(3-ethyl-3-methyl-1H-2-benzofuran-4-yl)oxy]-3-pyridinyl]-5,5-dimethylimidazolidine-2,4-dione
CID 123406731
(5R)-5-ethyl-5-methyl-3-(5-spiro[2H-1-benzofuran-3,1'-cyclopropane]-4-yloxypyrazin-2-yl)imidazolidine-2,4-dione
CID 146486754
(5R)-3-[6-(1,1a,2,7b-tetrahydrocyclopropa[c]chromen-7-yloxy)-3-pyridinyl]-5-ethyl-1,5-dimethylimidazolidine-2,4-dione
CID 163907065
(5R)-3-[6-[[(3R)-3-tert-butyl-1,3-dihydro-2-benzofuran-5-yl]oxy]-3-pyridinyl]-5-ethyl-5-methylimidazolidine-2,4-dione
CID 141458184
(5R)-5-ethyl-5-methyl-3-(6-spiro[1H-2-benzofuran-3,1'-cyclopentane]-5-yloxy-3-pyridinyl)imidazolidine-2,4-dione
CID 71090096
tert-butyl N-[(2R)-2-methyl-1-[[6-[(3-methyl-3,4-dihydro-2H-chromen-5-yl)oxy]-3-pyridinyl]amino]-1-oxobutan-2-yl]carbamate
CID 86698444

Frequently Asked Questions

What is the IUPAC name of (5R)-5-ethyl-5-methyl-3-[6-[[(3S)-3-methyl-3,4-dihydro-2H-chromen-5-yl]oxy]-3-pyridinyl]imidazolidine-2,4-dione?
The IUPAC name of (5R)-5-ethyl-5-methyl-3-[6-[[(3S)-3-methyl-3,4-dihydro-2H-chromen-5-yl]oxy]-3-pyridinyl]imidazolidine-2,4-dione (CID 152700236) is (5R)-5-ethyl-5-methyl-3-[6-[[(3S)-3-methyl-3,4-dihydro-2H-chromen-5-yl]oxy]-3-pyridinyl]imidazolidine-2,4-dione.
What is the SMILES notation for (5R)-5-ethyl-5-methyl-3-[6-[[(3S)-3-methyl-3,4-dihydro-2H-chromen-5-yl]oxy]-3-pyridinyl]imidazolidine-2,4-dione?
The canonical SMILES for (5R)-5-ethyl-5-methyl-3-[6-[[(3S)-3-methyl-3,4-dihydro-2H-chromen-5-yl]oxy]-3-pyridinyl]imidazolidine-2,4-dione is CC[C@@]1(C)NC(=O)N(c2ccc(Oc3cccc4c3C[C@H](C)CO4)nc2)C1=O.
What is the InChIKey of (5R)-5-ethyl-5-methyl-3-[6-[[(3S)-3-methyl-3,4-dihydro-2H-chromen-5-yl]oxy]-3-pyridinyl]imidazolidine-2,4-dione?
The InChIKey is ZRKOWATVZZCKMN-YEJXKQKISA-N. The full InChI is InChI=1S/C21H23N3O4/c1-4-21(3)19(25)24(20(26)23-21)14-8-9-18(22-11-14)28-17-7-5-6-16-15(17)10-13(2)12-27-16/h5-9,11,13H,4,10,12H2,1-3H3,(H,23,26)/t13-,21+/m0/s1.
What are the key properties of (5R)-5-ethyl-5-methyl-3-[6-[[(3S)-3-methyl-3,4-dihydro-2H-chromen-5-yl]oxy]-3-pyridinyl]imidazolidine-2,4-dione?
(5R)-5-ethyl-5-methyl-3-[6-[[(3S)-3-methyl-3,4-dihydro-2H-chromen-5-yl]oxy]-3-pyridinyl]imidazolidine-2,4-dione has a molecular weight of 381.43 g/mol, XLogP of 3.67, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-ethyl-5-methyl-3-[6-[[(3S)-3-methyl-3,4-dihydro-2H-chromen-5-yl]oxy]-3-pyridinyl]imidazolidine-2,4-dione is sourced from PubChem (CID 152700236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).