2-naphthalen-2-yloxy-N-[[(2S)-oxolan-2-yl]methyl]acetamide

C17H19NO3 — CID 874788

IUPAC2-naphthalen-2-yloxy-N-[[(2S)-oxolan-2-yl]methyl]acetamide
SMILESO=C(COc1ccc2ccccc2c1)NC[C@@H]1CCCO1
InChIInChI=1S/C17H19NO3/c19-17(18-11-16-6-3-9-20-16)12-21-15-8-7-13-4-1-2-5-14(13)10-15/h1-2,4-5,7-8,10,16H,3,6,9,11-12H2,(H,18,19)/t16-/m0/s1
InChIKeyXXWXJGJUFJIAHF-INIZCTEOSA-N
MW285.34 g/mol
LogP2.51
Rot. Bonds5

About 2-naphthalen-2-yloxy-N-[[(2S)-oxolan-2-yl]methyl]acetamide

2-naphthalen-2-yloxy-N-[[(2S)-oxolan-2-yl]methyl]acetamide (PubChem CID 874788) has the molecular formula C17H19NO3 and a molecular weight of 285.34 g/mol. Its IUPAC name is 2-naphthalen-2-yloxy-N-[[(2S)-oxolan-2-yl]methyl]acetamide.

Molecular Properties

Compound Name2-naphthalen-2-yloxy-N-[[(2S)-oxolan-2-yl]methyl]acetamide
PubChem CID874788
Molecular FormulaC17H19NO3
Molecular Weight285.34 g/mol
Exact Mass285.14
IUPAC Name2-naphthalen-2-yloxy-N-[[(2S)-oxolan-2-yl]methyl]acetamide
SMILESO=C(COc1ccc2ccccc2c1)NC[C@@H]1CCCO1
InChIInChI=1S/C17H19NO3/c19-17(18-11-16-6-3-9-20-16)12-21-15-8-7-13-4-1-2-5-14(13)10-15/h1-2,4-5,7-8,10,16H,3,6,9,11-12H2,(H,18,19)/t16-/m0/s1
InChIKeyXXWXJGJUFJIAHF-INIZCTEOSA-N
XLogP2.51
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.34
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-2-yloxy-N-[[(2S)-oxolan-2-yl]methyl]acetamide?
The IUPAC name of 2-naphthalen-2-yloxy-N-[[(2S)-oxolan-2-yl]methyl]acetamide (CID 874788) is 2-naphthalen-2-yloxy-N-[[(2S)-oxolan-2-yl]methyl]acetamide.
What is the SMILES notation for 2-naphthalen-2-yloxy-N-[[(2S)-oxolan-2-yl]methyl]acetamide?
The canonical SMILES for 2-naphthalen-2-yloxy-N-[[(2S)-oxolan-2-yl]methyl]acetamide is O=C(COc1ccc2ccccc2c1)NC[C@@H]1CCCO1.
What is the InChIKey of 2-naphthalen-2-yloxy-N-[[(2S)-oxolan-2-yl]methyl]acetamide?
The InChIKey is XXWXJGJUFJIAHF-INIZCTEOSA-N. The full InChI is InChI=1S/C17H19NO3/c19-17(18-11-16-6-3-9-20-16)12-21-15-8-7-13-4-1-2-5-14(13)10-15/h1-2,4-5,7-8,10,16H,3,6,9,11-12H2,(H,18,19)/t16-/m0/s1.
What are the key properties of 2-naphthalen-2-yloxy-N-[[(2S)-oxolan-2-yl]methyl]acetamide?
2-naphthalen-2-yloxy-N-[[(2S)-oxolan-2-yl]methyl]acetamide has a molecular weight of 285.34 g/mol, XLogP of 2.51, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-2-yloxy-N-[[(2S)-oxolan-2-yl]methyl]acetamide is sourced from PubChem (CID 874788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).