2-naphthalen-2-yloxy-N-[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]acetamide

C23H23NO4 — CID 9295169

IUPAC2-naphthalen-2-yloxy-N-[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]acetamide
SMILESO=C(COc1ccc2ccccc2c1)Nc1ccc(OC[C@@H]2CCCO2)cc1
InChIInChI=1S/C23H23NO4/c25-23(16-28-21-10-7-17-4-1-2-5-18(17)14-21)24-19-8-11-20(12-9-19)27-15-22-6-3-13-26-22/h1-2,4-5,7-12,14,22H,3,6,13,15-16H2,(H,24,25)/t22-/m0/s1
InChIKeyHCMWVHJQQLAWME-QFIPXVFZSA-N
MW377.44 g/mol
LogP4.42
Rot. Bonds7

About 2-naphthalen-2-yloxy-N-[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]acetamide

2-naphthalen-2-yloxy-N-[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]acetamide (PubChem CID 9295169) has the molecular formula C23H23NO4 and a molecular weight of 377.44 g/mol. Its IUPAC name is 2-naphthalen-2-yloxy-N-[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]acetamide.

Molecular Properties

Compound Name2-naphthalen-2-yloxy-N-[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]acetamide
PubChem CID9295169
Molecular FormulaC23H23NO4
Molecular Weight377.44 g/mol
Exact Mass377.16
IUPAC Name2-naphthalen-2-yloxy-N-[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]acetamide
SMILESO=C(COc1ccc2ccccc2c1)Nc1ccc(OC[C@@H]2CCCO2)cc1
InChIInChI=1S/C23H23NO4/c25-23(16-28-21-10-7-17-4-1-2-5-18(17)14-21)24-19-8-11-20(12-9-19)27-15-22-6-3-13-26-22/h1-2,4-5,7-12,14,22H,3,6,13,15-16H2,(H,24,25)/t22-/m0/s1
InChIKeyHCMWVHJQQLAWME-QFIPXVFZSA-N
XLogP4.42
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.44
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-2-yloxy-N-[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]acetamide?
The IUPAC name of 2-naphthalen-2-yloxy-N-[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]acetamide (CID 9295169) is 2-naphthalen-2-yloxy-N-[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]acetamide.
What is the SMILES notation for 2-naphthalen-2-yloxy-N-[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]acetamide?
The canonical SMILES for 2-naphthalen-2-yloxy-N-[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]acetamide is O=C(COc1ccc2ccccc2c1)Nc1ccc(OC[C@@H]2CCCO2)cc1.
What is the InChIKey of 2-naphthalen-2-yloxy-N-[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]acetamide?
The InChIKey is HCMWVHJQQLAWME-QFIPXVFZSA-N. The full InChI is InChI=1S/C23H23NO4/c25-23(16-28-21-10-7-17-4-1-2-5-18(17)14-21)24-19-8-11-20(12-9-19)27-15-22-6-3-13-26-22/h1-2,4-5,7-12,14,22H,3,6,13,15-16H2,(H,24,25)/t22-/m0/s1.
What are the key properties of 2-naphthalen-2-yloxy-N-[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]acetamide?
2-naphthalen-2-yloxy-N-[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]acetamide has a molecular weight of 377.44 g/mol, XLogP of 4.42, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-2-yloxy-N-[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]acetamide is sourced from PubChem (CID 9295169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).