1-(azetidin-3-yl)-4-naphthalen-2-ylimidazolidin-2-one

C16H17N3O — CID 116978947

IUPAC1-(azetidin-3-yl)-4-naphthalen-2-ylimidazolidin-2-one
SMILESO=C1NC(c2ccc3ccccc3c2)CN1C1CNC1
InChIInChI=1S/C16H17N3O/c20-16-18-15(10-19(16)14-8-17-9-14)13-6-5-11-3-1-2-4-12(11)7-13/h1-7,14-15,17H,8-10H2,(H,18,20)
InChIKeyJNJSARDLEOIGDY-UHFFFAOYSA-N
MW267.33 g/mol
LogP1.88
Rot. Bonds2

About 1-(azetidin-3-yl)-4-naphthalen-2-ylimidazolidin-2-one

1-(azetidin-3-yl)-4-naphthalen-2-ylimidazolidin-2-one (PubChem CID 116978947) has the molecular formula C16H17N3O and a molecular weight of 267.33 g/mol. Its IUPAC name is 1-(azetidin-3-yl)-4-naphthalen-2-ylimidazolidin-2-one.

Molecular Properties

Compound Name1-(azetidin-3-yl)-4-naphthalen-2-ylimidazolidin-2-one
PubChem CID116978947
Molecular FormulaC16H17N3O
Molecular Weight267.33 g/mol
Exact Mass267.14
IUPAC Name1-(azetidin-3-yl)-4-naphthalen-2-ylimidazolidin-2-one
SMILESO=C1NC(c2ccc3ccccc3c2)CN1C1CNC1
InChIInChI=1S/C16H17N3O/c20-16-18-15(10-19(16)14-8-17-9-14)13-6-5-11-3-1-2-4-12(11)7-13/h1-7,14-15,17H,8-10H2,(H,18,20)
InChIKeyJNJSARDLEOIGDY-UHFFFAOYSA-N
XLogP1.88
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-(4-bromophenyl)-1-pyrrolidin-3-ylimidazolidin-2-one
CID 116978967
3-naphthalen-2-ylazetidine
CID 116962282
(4S)-4-naphthalen-2-yl-1,3-oxazinan-2-one;hydrochloride
CID 171185570
1-ethyl-4-(6-methylnaphthalen-2-yl)imidazolidin-2-one
CID 116981065
(2S)-2-naphthalen-2-yl-1,2,3,4-tetrahydroquinoline
CID 102250958
3-naphthalen-2-yl-1,2-oxazolidine
CID 164533749
(5R)-5-naphthalen-2-ylimidazolidine-2,4-dione
CID 94042985
5-naphthalen-2-yl-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrole;hydrochloride
CID 155345745
3-methyl-4-naphthalen-2-ylpiperidine
CID 66277961
3-naphthalen-2-ylpiperidine;hydrochloride
CID 45073830
2-naphthalen-2-yl-2,3-dihydro-1,3-benzoxazin-4-one
CID 6489068
3-methyl-5-naphthalen-2-ylpiperidine
CID 115375238

Frequently Asked Questions

What is the IUPAC name of 1-(azetidin-3-yl)-4-naphthalen-2-ylimidazolidin-2-one?
The IUPAC name of 1-(azetidin-3-yl)-4-naphthalen-2-ylimidazolidin-2-one (CID 116978947) is 1-(azetidin-3-yl)-4-naphthalen-2-ylimidazolidin-2-one.
What is the SMILES notation for 1-(azetidin-3-yl)-4-naphthalen-2-ylimidazolidin-2-one?
The canonical SMILES for 1-(azetidin-3-yl)-4-naphthalen-2-ylimidazolidin-2-one is O=C1NC(c2ccc3ccccc3c2)CN1C1CNC1.
What is the InChIKey of 1-(azetidin-3-yl)-4-naphthalen-2-ylimidazolidin-2-one?
The InChIKey is JNJSARDLEOIGDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O/c20-16-18-15(10-19(16)14-8-17-9-14)13-6-5-11-3-1-2-4-12(11)7-13/h1-7,14-15,17H,8-10H2,(H,18,20).
What are the key properties of 1-(azetidin-3-yl)-4-naphthalen-2-ylimidazolidin-2-one?
1-(azetidin-3-yl)-4-naphthalen-2-ylimidazolidin-2-one has a molecular weight of 267.33 g/mol, XLogP of 1.88, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(azetidin-3-yl)-4-naphthalen-2-ylimidazolidin-2-one is sourced from PubChem (CID 116978947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).