4-naphthalen-1-yl-1,3-dihydroimidazol-2-one

C13H10N2O — CID 116879771

IUPAC4-naphthalen-1-yl-1,3-dihydroimidazol-2-one
SMILESO=c1[nH]cc(-c2cccc3ccccc23)[nH]1
InChIInChI=1S/C13H10N2O/c16-13-14-8-12(15-13)11-7-3-5-9-4-1-2-6-10(9)11/h1-8H,(H2,14,15,16)
InChIKeyJBYMYKSVSBUPQD-UHFFFAOYSA-N
MW210.24 g/mol
LogP2.52
Rot. Bonds1

About 4-naphthalen-1-yl-1,3-dihydroimidazol-2-one

4-naphthalen-1-yl-1,3-dihydroimidazol-2-one (PubChem CID 116879771) has the molecular formula C13H10N2O and a molecular weight of 210.24 g/mol. Its IUPAC name is 4-naphthalen-1-yl-1,3-dihydroimidazol-2-one.

Molecular Properties

Compound Name4-naphthalen-1-yl-1,3-dihydroimidazol-2-one
PubChem CID116879771
Molecular FormulaC13H10N2O
Molecular Weight210.24 g/mol
Exact Mass210.08
IUPAC Name4-naphthalen-1-yl-1,3-dihydroimidazol-2-one
SMILESO=c1[nH]cc(-c2cccc3ccccc23)[nH]1
InChIInChI=1S/C13H10N2O/c16-13-14-8-12(15-13)11-7-3-5-9-4-1-2-6-10(9)11/h1-8H,(H2,14,15,16)
InChIKeyJBYMYKSVSBUPQD-UHFFFAOYSA-N
XLogP2.52
TPSA48.65 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-naphthalen-1-yl-1,3-dihydroimidazol-2-one?
The IUPAC name of 4-naphthalen-1-yl-1,3-dihydroimidazol-2-one (CID 116879771) is 4-naphthalen-1-yl-1,3-dihydroimidazol-2-one.
What is the SMILES notation for 4-naphthalen-1-yl-1,3-dihydroimidazol-2-one?
The canonical SMILES for 4-naphthalen-1-yl-1,3-dihydroimidazol-2-one is O=c1[nH]cc(-c2cccc3ccccc23)[nH]1.
What is the InChIKey of 4-naphthalen-1-yl-1,3-dihydroimidazol-2-one?
The InChIKey is JBYMYKSVSBUPQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N2O/c16-13-14-8-12(15-13)11-7-3-5-9-4-1-2-6-10(9)11/h1-8H,(H2,14,15,16).
What are the key properties of 4-naphthalen-1-yl-1,3-dihydroimidazol-2-one?
4-naphthalen-1-yl-1,3-dihydroimidazol-2-one has a molecular weight of 210.24 g/mol, XLogP of 2.52, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-naphthalen-1-yl-1,3-dihydroimidazol-2-one is sourced from PubChem (CID 116879771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).