(5Z)-5-(naphthalen-1-ylmethylidene)imidazolidine-2,4-dione

C14H10N2O2 — CID 22377067

IUPAC(5Z)-5-(naphthalen-1-ylmethylidene)imidazolidine-2,4-dione
SMILESO=C1NC(=O)/C(=C/c2cccc3ccccc23)N1
InChIInChI=1S/C14H10N2O2/c17-13-12(15-14(18)16-13)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-8H,(H2,15,16,17,18)/b12-8-
InChIKeyPRXSTEDJAPTRPG-WQLSENKSSA-N
MW238.25 g/mol
LogP2.02
Rot. Bonds1

About (5Z)-5-(naphthalen-1-ylmethylidene)imidazolidine-2,4-dione

(5Z)-5-(naphthalen-1-ylmethylidene)imidazolidine-2,4-dione (PubChem CID 22377067) has the molecular formula C14H10N2O2 and a molecular weight of 238.25 g/mol. Its IUPAC name is (5Z)-5-(naphthalen-1-ylmethylidene)imidazolidine-2,4-dione.

Molecular Properties

Compound Name(5Z)-5-(naphthalen-1-ylmethylidene)imidazolidine-2,4-dione
PubChem CID22377067
Molecular FormulaC14H10N2O2
Molecular Weight238.25 g/mol
Exact Mass238.07
IUPAC Name(5Z)-5-(naphthalen-1-ylmethylidene)imidazolidine-2,4-dione
SMILESO=C1NC(=O)/C(=C/c2cccc3ccccc23)N1
InChIInChI=1S/C14H10N2O2/c17-13-12(15-14(18)16-13)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-8H,(H2,15,16,17,18)/b12-8-
InChIKeyPRXSTEDJAPTRPG-WQLSENKSSA-N
XLogP2.02
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.25
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

(5Z)-5-(Phenylmethylene)-2,4-imidazolidinedione
CID 5706042
5-(2-Naphthylmethylene)-2-thioxo-4-imidazolidinone
CID 677488
5-Benzylidenehydantoin
CID 97857
(6Z)-3-methylidene-6-(naphthalen-2-ylmethylidene)piperazine-2,5-dione
CID 166625305
5-(4-Isopropylbenzylidene)-2,4-imidazolidinedione
CID 697473
5-(1-Naphthylmethylene)-2-thioxo-4-imidazolidinone
CID 760732
5-Phenylmethylenehydantoin
CID 843551
(5Z)-5-(2-methylbenzylidene)imidazolidine-2,4-dione
CID 2163084
5-[[3-(Trifluoromethyl)phenyl]methylidene]imidazolidine-2,4-dione
CID 3059464
Hydantoin, 5-(m-(trifluoromethyl)benzylidene)-
CID 6447487
(5Z)-5-(3-methylbenzylidene)imidazolidine-2,4-dione
CID 697135
5-(4-Biphenylylmethylene)-2,4-imidazolidinedione
CID 2176337

Frequently Asked Questions

What is the IUPAC name of (5Z)-5-(naphthalen-1-ylmethylidene)imidazolidine-2,4-dione?
The IUPAC name of (5Z)-5-(naphthalen-1-ylmethylidene)imidazolidine-2,4-dione (CID 22377067) is (5Z)-5-(naphthalen-1-ylmethylidene)imidazolidine-2,4-dione.
What is the SMILES notation for (5Z)-5-(naphthalen-1-ylmethylidene)imidazolidine-2,4-dione?
The canonical SMILES for (5Z)-5-(naphthalen-1-ylmethylidene)imidazolidine-2,4-dione is O=C1NC(=O)/C(=C/c2cccc3ccccc23)N1.
What is the InChIKey of (5Z)-5-(naphthalen-1-ylmethylidene)imidazolidine-2,4-dione?
The InChIKey is PRXSTEDJAPTRPG-WQLSENKSSA-N. The full InChI is InChI=1S/C14H10N2O2/c17-13-12(15-14(18)16-13)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-8H,(H2,15,16,17,18)/b12-8-.
What are the key properties of (5Z)-5-(naphthalen-1-ylmethylidene)imidazolidine-2,4-dione?
(5Z)-5-(naphthalen-1-ylmethylidene)imidazolidine-2,4-dione has a molecular weight of 238.25 g/mol, XLogP of 2.02, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z)-5-(naphthalen-1-ylmethylidene)imidazolidine-2,4-dione is sourced from PubChem (CID 22377067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).