(2S)-2-methoxy-N-[(1S)-1-naphthalen-2-ylpropyl]-2-phenylacetamide

C22H23NO2 — CID 70094116

IUPAC(2S)-2-methoxy-N-[(1S)-1-naphthalen-2-ylpropyl]-2-phenylacetamide
SMILESCC[C@H](NC(=O)[C@@H](OC)c1ccccc1)c1ccc2ccccc2c1
InChIInChI=1S/C22H23NO2/c1-3-20(19-14-13-16-9-7-8-12-18(16)15-19)23-22(24)21(25-2)17-10-5-4-6-11-17/h4-15,20-21H,3H2,1-2H3,(H,23,24)/t20-,21-/m0/s1
InChIKeyXFEOWQUMVPZEHI-SFTDATJTSA-N
MW333.43 g/mol
LogP4.79
Rot. Bonds6

About (2S)-2-methoxy-N-[(1S)-1-naphthalen-2-ylpropyl]-2-phenylacetamide

(2S)-2-methoxy-N-[(1S)-1-naphthalen-2-ylpropyl]-2-phenylacetamide (PubChem CID 70094116) has the molecular formula C22H23NO2 and a molecular weight of 333.43 g/mol. Its IUPAC name is (2S)-2-methoxy-N-[(1S)-1-naphthalen-2-ylpropyl]-2-phenylacetamide.

Molecular Properties

Compound Name(2S)-2-methoxy-N-[(1S)-1-naphthalen-2-ylpropyl]-2-phenylacetamide
PubChem CID70094116
Molecular FormulaC22H23NO2
Molecular Weight333.43 g/mol
Exact Mass333.17
IUPAC Name(2S)-2-methoxy-N-[(1S)-1-naphthalen-2-ylpropyl]-2-phenylacetamide
SMILESCC[C@H](NC(=O)[C@@H](OC)c1ccccc1)c1ccc2ccccc2c1
InChIInChI=1S/C22H23NO2/c1-3-20(19-14-13-16-9-7-8-12-18(16)15-19)23-22(24)21(25-2)17-10-5-4-6-11-17/h4-15,20-21H,3H2,1-2H3,(H,23,24)/t20-,21-/m0/s1
InChIKeyXFEOWQUMVPZEHI-SFTDATJTSA-N
XLogP4.79
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.43
LogP ≤ 54.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-N-[3-(dimethylamino)-1-naphthalen-2-ylpropyl]-2-methoxy-2-phenylacetamide
CID 24955191
(2S)-2-naphthalen-2-yloxy-N-[(1S)-1-phenylpropyl]butanamide
CID 28636082
N-(2-amino-1-phenylethyl)-2-methoxy-2-phenylacetamide
CID 63755766
N-[1-(4-methoxyphenyl)propyl]-2,2-diphenylacetamide
CID 55371775
N-(1-aminobutan-2-yl)-2-methoxy-2-phenylacetamide
CID 63753357
N-(3-hydroxy-1-phenylpropyl)-2-methoxy-2-phenylacetamide
CID 110025911
N-[1-(4-methoxyphenyl)propyl]-2-phenylbutanamide
CID 43027690
2-(2-methoxybutanoylamino)-2-naphthalen-2-ylacetic acid
CID 120543590
N-[1-(4-methylphenyl)propyl]-2-naphthalen-2-yloxybutanamide
CID 17328429
(2S)-2-[(2-methoxy-2-phenylacetyl)amino]propanoic acid
CID 78986376
(2S)-2-methoxy-2-phenyl-N-[(1R)-1-phenylethyl]acetamide
CID 10378386
N-hex-5-yn-3-yl-2-methoxy-2-phenylacetamide
CID 113241228

Frequently Asked Questions

What is the IUPAC name of (2S)-2-methoxy-N-[(1S)-1-naphthalen-2-ylpropyl]-2-phenylacetamide?
The IUPAC name of (2S)-2-methoxy-N-[(1S)-1-naphthalen-2-ylpropyl]-2-phenylacetamide (CID 70094116) is (2S)-2-methoxy-N-[(1S)-1-naphthalen-2-ylpropyl]-2-phenylacetamide.
What is the SMILES notation for (2S)-2-methoxy-N-[(1S)-1-naphthalen-2-ylpropyl]-2-phenylacetamide?
The canonical SMILES for (2S)-2-methoxy-N-[(1S)-1-naphthalen-2-ylpropyl]-2-phenylacetamide is CC[C@H](NC(=O)[C@@H](OC)c1ccccc1)c1ccc2ccccc2c1.
What is the InChIKey of (2S)-2-methoxy-N-[(1S)-1-naphthalen-2-ylpropyl]-2-phenylacetamide?
The InChIKey is XFEOWQUMVPZEHI-SFTDATJTSA-N. The full InChI is InChI=1S/C22H23NO2/c1-3-20(19-14-13-16-9-7-8-12-18(16)15-19)23-22(24)21(25-2)17-10-5-4-6-11-17/h4-15,20-21H,3H2,1-2H3,(H,23,24)/t20-,21-/m0/s1.
What are the key properties of (2S)-2-methoxy-N-[(1S)-1-naphthalen-2-ylpropyl]-2-phenylacetamide?
(2S)-2-methoxy-N-[(1S)-1-naphthalen-2-ylpropyl]-2-phenylacetamide has a molecular weight of 333.43 g/mol, XLogP of 4.79, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-methoxy-N-[(1S)-1-naphthalen-2-ylpropyl]-2-phenylacetamide is sourced from PubChem (CID 70094116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).