(5S)-5-(naphthalen-2-ylmethyl)imidazolidine-2,4-dione

C14H12N2O2 — CID 74983340

IUPAC(5S)-5-(naphthalen-2-ylmethyl)imidazolidine-2,4-dione
SMILESO=C1NC(=O)[C@H](Cc2ccc3ccccc3c2)N1
InChIInChI=1S/C14H12N2O2/c17-13-12(15-14(18)16-13)8-9-5-6-10-3-1-2-4-11(10)7-9/h1-7,12H,8H2,(H2,15,16,17,18)/t12-/m0/s1
InChIKeyCHRJCAZBQNADBP-LBPRGKRZSA-N
MW240.26 g/mol
LogP1.59
Rot. Bonds2

About (5S)-5-(naphthalen-2-ylmethyl)imidazolidine-2,4-dione

(5S)-5-(naphthalen-2-ylmethyl)imidazolidine-2,4-dione (PubChem CID 74983340) has the molecular formula C14H12N2O2 and a molecular weight of 240.26 g/mol. Its IUPAC name is (5S)-5-(naphthalen-2-ylmethyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name(5S)-5-(naphthalen-2-ylmethyl)imidazolidine-2,4-dione
PubChem CID74983340
Molecular FormulaC14H12N2O2
Molecular Weight240.26 g/mol
Exact Mass240.09
IUPAC Name(5S)-5-(naphthalen-2-ylmethyl)imidazolidine-2,4-dione
SMILESO=C1NC(=O)[C@H](Cc2ccc3ccccc3c2)N1
InChIInChI=1S/C14H12N2O2/c17-13-12(15-14(18)16-13)8-9-5-6-10-3-1-2-4-11(10)7-9/h1-7,12H,8H2,(H2,15,16,17,18)/t12-/m0/s1
InChIKeyCHRJCAZBQNADBP-LBPRGKRZSA-N
XLogP1.59
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.26
LogP ≤ 51.59
H-Bond Donors ≤ 52
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-(naphthalen-2-ylmethyl)imidazolidine-2,4-dione?
The IUPAC name of (5S)-5-(naphthalen-2-ylmethyl)imidazolidine-2,4-dione (CID 74983340) is (5S)-5-(naphthalen-2-ylmethyl)imidazolidine-2,4-dione.
What is the SMILES notation for (5S)-5-(naphthalen-2-ylmethyl)imidazolidine-2,4-dione?
The canonical SMILES for (5S)-5-(naphthalen-2-ylmethyl)imidazolidine-2,4-dione is O=C1NC(=O)[C@H](Cc2ccc3ccccc3c2)N1.
What is the InChIKey of (5S)-5-(naphthalen-2-ylmethyl)imidazolidine-2,4-dione?
The InChIKey is CHRJCAZBQNADBP-LBPRGKRZSA-N. The full InChI is InChI=1S/C14H12N2O2/c17-13-12(15-14(18)16-13)8-9-5-6-10-3-1-2-4-11(10)7-9/h1-7,12H,8H2,(H2,15,16,17,18)/t12-/m0/s1.
What are the key properties of (5S)-5-(naphthalen-2-ylmethyl)imidazolidine-2,4-dione?
(5S)-5-(naphthalen-2-ylmethyl)imidazolidine-2,4-dione has a molecular weight of 240.26 g/mol, XLogP of 1.59, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-5-(naphthalen-2-ylmethyl)imidazolidine-2,4-dione is sourced from PubChem (CID 74983340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).