1-naphthalen-2-yl-2-[(2S)-oxolan-2-yl]ethanone

C16H16O2 — CID 155933757

IUPAC1-naphthalen-2-yl-2-[(2S)-oxolan-2-yl]ethanone
SMILESO=C(C[C@@H]1CCCO1)c1ccc2ccccc2c1
InChIInChI=1S/C16H16O2/c17-16(11-15-6-3-9-18-15)14-8-7-12-4-1-2-5-13(12)10-14/h1-2,4-5,7-8,10,15H,3,6,9,11H2/t15-/m0/s1
InChIKeyMFYUMHJITLXPFW-HNNXBMFYSA-N
MW240.30 g/mol
LogP3.59
Rot. Bonds3

About 1-naphthalen-2-yl-2-[(2S)-oxolan-2-yl]ethanone

1-naphthalen-2-yl-2-[(2S)-oxolan-2-yl]ethanone (PubChem CID 155933757) has the molecular formula C16H16O2 and a molecular weight of 240.30 g/mol. Its IUPAC name is 1-naphthalen-2-yl-2-[(2S)-oxolan-2-yl]ethanone.

Molecular Properties

Compound Name1-naphthalen-2-yl-2-[(2S)-oxolan-2-yl]ethanone
PubChem CID155933757
Molecular FormulaC16H16O2
Molecular Weight240.30 g/mol
Exact Mass240.12
IUPAC Name1-naphthalen-2-yl-2-[(2S)-oxolan-2-yl]ethanone
SMILESO=C(C[C@@H]1CCCO1)c1ccc2ccccc2c1
InChIInChI=1S/C16H16O2/c17-16(11-15-6-3-9-18-15)14-8-7-12-4-1-2-5-13(12)10-14/h1-2,4-5,7-8,10,15H,3,6,9,11H2/t15-/m0/s1
InChIKeyMFYUMHJITLXPFW-HNNXBMFYSA-N
XLogP3.59
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.30
LogP ≤ 53.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-2-yl-2-[(2S)-oxolan-2-yl]ethanone?
The IUPAC name of 1-naphthalen-2-yl-2-[(2S)-oxolan-2-yl]ethanone (CID 155933757) is 1-naphthalen-2-yl-2-[(2S)-oxolan-2-yl]ethanone.
What is the SMILES notation for 1-naphthalen-2-yl-2-[(2S)-oxolan-2-yl]ethanone?
The canonical SMILES for 1-naphthalen-2-yl-2-[(2S)-oxolan-2-yl]ethanone is O=C(C[C@@H]1CCCO1)c1ccc2ccccc2c1.
What is the InChIKey of 1-naphthalen-2-yl-2-[(2S)-oxolan-2-yl]ethanone?
The InChIKey is MFYUMHJITLXPFW-HNNXBMFYSA-N. The full InChI is InChI=1S/C16H16O2/c17-16(11-15-6-3-9-18-15)14-8-7-12-4-1-2-5-13(12)10-14/h1-2,4-5,7-8,10,15H,3,6,9,11H2/t15-/m0/s1.
What are the key properties of 1-naphthalen-2-yl-2-[(2S)-oxolan-2-yl]ethanone?
1-naphthalen-2-yl-2-[(2S)-oxolan-2-yl]ethanone has a molecular weight of 240.30 g/mol, XLogP of 3.59, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-naphthalen-2-yl-2-[(2S)-oxolan-2-yl]ethanone is sourced from PubChem (CID 155933757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).