(5R)-1,3-dimethyl-5-(naphthalen-1-ylmethyl)imidazolidine-2,4-dione

C16H16N2O2 — CID 131844513

IUPAC(5R)-1,3-dimethyl-5-(naphthalen-1-ylmethyl)imidazolidine-2,4-dione
SMILESCN1C(=O)[C@@H](Cc2cccc3ccccc23)N(C)C1=O
InChIInChI=1S/C16H16N2O2/c1-17-14(15(19)18(2)16(17)20)10-12-8-5-7-11-6-3-4-9-13(11)12/h3-9,14H,10H2,1-2H3/t14-/m1/s1
InChIKeyYFMYLXFAFJFWSF-CQSZACIVSA-N
MW268.32 g/mol
LogP2.27
Rot. Bonds2

About (5R)-1,3-dimethyl-5-(naphthalen-1-ylmethyl)imidazolidine-2,4-dione

(5R)-1,3-dimethyl-5-(naphthalen-1-ylmethyl)imidazolidine-2,4-dione (PubChem CID 131844513) has the molecular formula C16H16N2O2 and a molecular weight of 268.32 g/mol. Its IUPAC name is (5R)-1,3-dimethyl-5-(naphthalen-1-ylmethyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name(5R)-1,3-dimethyl-5-(naphthalen-1-ylmethyl)imidazolidine-2,4-dione
PubChem CID131844513
Molecular FormulaC16H16N2O2
Molecular Weight268.32 g/mol
Exact Mass268.12
IUPAC Name(5R)-1,3-dimethyl-5-(naphthalen-1-ylmethyl)imidazolidine-2,4-dione
SMILESCN1C(=O)[C@@H](Cc2cccc3ccccc23)N(C)C1=O
InChIInChI=1S/C16H16N2O2/c1-17-14(15(19)18(2)16(17)20)10-12-8-5-7-11-6-3-4-9-13(11)12/h3-9,14H,10H2,1-2H3/t14-/m1/s1
InChIKeyYFMYLXFAFJFWSF-CQSZACIVSA-N
XLogP2.27
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1,3,7-trimethyl-5-(naphthalen-1-ylmethylsulfanyl)-4a,5,6,7,8,8a-hexahydropyrimido[4,5-d]pyrimidine-2,4-dione
CID 156590470
1,3-dimethyl-5-(naphthalen-1-ylmethylsulfanyl)-4a,5,6,7,8,8a-hexahydropyrido[2,3-d]pyrimidine-2,4-dione
CID 78482457
5-[(4-methoxynaphthalen-1-yl)methyl]-1,3-dimethyl-1,3-diazinane-2,4,6-trione
CID 171982462
1,3-dimethyl-5-(sulfanylmethyl)imidazolidine-2,4-dione
CID 87233904
(4R)-4-[(2-hydroxyphenyl)methyl]-2-methyl-4H-pyrazino[2,1-b]quinazoline-1,3,6-trione
CID 164620180
5-benzyl-1-methyl-3-phenylimidazolidine-2,4-dione
CID 12790757
azane;1-ethylnaphthalene
CID 19048185
8-ethylsulfanyl-1,3-dimethyl-7-(naphthalen-1-ylmethyl)-5H-purin-7-ium-2,6-dione
CID 78214418
(5R)-5-(naphthalen-1-ylmethyl)-1,3-thiazolidine-2,4-dione
CID 129391217
6-benzyl-1,4-dimethylpiperazine-2,3,5-trione
CID 13416223
(3S)-3-[(3,4-dichlorophenyl)methyl]-4-methyl-1-(naphthalen-1-ylmethyl)-1,4-diazepane-2,5-dione
CID 69365882
sodium;1-ethylnaphthalene;hydride
CID 174300793

Frequently Asked Questions

What is the IUPAC name of (5R)-1,3-dimethyl-5-(naphthalen-1-ylmethyl)imidazolidine-2,4-dione?
The IUPAC name of (5R)-1,3-dimethyl-5-(naphthalen-1-ylmethyl)imidazolidine-2,4-dione (CID 131844513) is (5R)-1,3-dimethyl-5-(naphthalen-1-ylmethyl)imidazolidine-2,4-dione.
What is the SMILES notation for (5R)-1,3-dimethyl-5-(naphthalen-1-ylmethyl)imidazolidine-2,4-dione?
The canonical SMILES for (5R)-1,3-dimethyl-5-(naphthalen-1-ylmethyl)imidazolidine-2,4-dione is CN1C(=O)[C@@H](Cc2cccc3ccccc23)N(C)C1=O.
What is the InChIKey of (5R)-1,3-dimethyl-5-(naphthalen-1-ylmethyl)imidazolidine-2,4-dione?
The InChIKey is YFMYLXFAFJFWSF-CQSZACIVSA-N. The full InChI is InChI=1S/C16H16N2O2/c1-17-14(15(19)18(2)16(17)20)10-12-8-5-7-11-6-3-4-9-13(11)12/h3-9,14H,10H2,1-2H3/t14-/m1/s1.
What are the key properties of (5R)-1,3-dimethyl-5-(naphthalen-1-ylmethyl)imidazolidine-2,4-dione?
(5R)-1,3-dimethyl-5-(naphthalen-1-ylmethyl)imidazolidine-2,4-dione has a molecular weight of 268.32 g/mol, XLogP of 2.27, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-1,3-dimethyl-5-(naphthalen-1-ylmethyl)imidazolidine-2,4-dione is sourced from PubChem (CID 131844513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).