N-[(1S)-1-naphthalen-2-ylethyl]-2-phenoxyacetamide

C20H19NO2 — CID 7899710

IUPACN-[(1S)-1-naphthalen-2-ylethyl]-2-phenoxyacetamide
SMILESC[C@H](NC(=O)COc1ccccc1)c1ccc2ccccc2c1
InChIInChI=1S/C20H19NO2/c1-15(17-12-11-16-7-5-6-8-18(16)13-17)21-20(22)14-23-19-9-3-2-4-10-19/h2-13,15H,14H2,1H3,(H,21,22)/t15-/m0/s1
InChIKeyRCQCHUILJNCKKG-HNNXBMFYSA-N
MW305.38 g/mol
LogP4.10
Rot. Bonds5

About N-[(1S)-1-naphthalen-2-ylethyl]-2-phenoxyacetamide

N-[(1S)-1-naphthalen-2-ylethyl]-2-phenoxyacetamide (PubChem CID 7899710) has the molecular formula C20H19NO2 and a molecular weight of 305.38 g/mol. Its IUPAC name is N-[(1S)-1-naphthalen-2-ylethyl]-2-phenoxyacetamide.

Molecular Properties

Compound NameN-[(1S)-1-naphthalen-2-ylethyl]-2-phenoxyacetamide
PubChem CID7899710
Molecular FormulaC20H19NO2
Molecular Weight305.38 g/mol
Exact Mass305.14
IUPAC NameN-[(1S)-1-naphthalen-2-ylethyl]-2-phenoxyacetamide
SMILESC[C@H](NC(=O)COc1ccccc1)c1ccc2ccccc2c1
InChIInChI=1S/C20H19NO2/c1-15(17-12-11-16-7-5-6-8-18(16)13-17)21-20(22)14-23-19-9-3-2-4-10-19/h2-13,15H,14H2,1H3,(H,21,22)/t15-/m0/s1
InChIKeyRCQCHUILJNCKKG-HNNXBMFYSA-N
XLogP4.10
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1-naphthalen-2-ylethyl]-2-phenoxyacetamide?
The IUPAC name of N-[(1S)-1-naphthalen-2-ylethyl]-2-phenoxyacetamide (CID 7899710) is N-[(1S)-1-naphthalen-2-ylethyl]-2-phenoxyacetamide.
What is the SMILES notation for N-[(1S)-1-naphthalen-2-ylethyl]-2-phenoxyacetamide?
The canonical SMILES for N-[(1S)-1-naphthalen-2-ylethyl]-2-phenoxyacetamide is C[C@H](NC(=O)COc1ccccc1)c1ccc2ccccc2c1.
What is the InChIKey of N-[(1S)-1-naphthalen-2-ylethyl]-2-phenoxyacetamide?
The InChIKey is RCQCHUILJNCKKG-HNNXBMFYSA-N. The full InChI is InChI=1S/C20H19NO2/c1-15(17-12-11-16-7-5-6-8-18(16)13-17)21-20(22)14-23-19-9-3-2-4-10-19/h2-13,15H,14H2,1H3,(H,21,22)/t15-/m0/s1.
What are the key properties of N-[(1S)-1-naphthalen-2-ylethyl]-2-phenoxyacetamide?
N-[(1S)-1-naphthalen-2-ylethyl]-2-phenoxyacetamide has a molecular weight of 305.38 g/mol, XLogP of 4.10, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1-naphthalen-2-ylethyl]-2-phenoxyacetamide is sourced from PubChem (CID 7899710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).