(2S)-N-(3-acetamidophenyl)-2-naphthalen-2-yloxypropanamide

C21H20N2O3 — CID 42561585

IUPAC(2S)-N-(3-acetamidophenyl)-2-naphthalen-2-yloxypropanamide
SMILESCC(=O)Nc1cccc(NC(=O)[C@H](C)Oc2ccc3ccccc3c2)c1
InChIInChI=1S/C21H20N2O3/c1-14(26-20-11-10-16-6-3-4-7-17(16)12-20)21(25)23-19-9-5-8-18(13-19)22-15(2)24/h3-14H,1-2H3,(H,22,24)(H,23,25)/t14-/m0/s1
InChIKeyBCBKLVQGVPODDA-AWEZNQCLSA-N
MW348.40 g/mol
LogP4.20
Rot. Bonds5

About (2S)-N-(3-acetamidophenyl)-2-naphthalen-2-yloxypropanamide

(2S)-N-(3-acetamidophenyl)-2-naphthalen-2-yloxypropanamide (PubChem CID 42561585) has the molecular formula C21H20N2O3 and a molecular weight of 348.40 g/mol. Its IUPAC name is (2S)-N-(3-acetamidophenyl)-2-naphthalen-2-yloxypropanamide.

Molecular Properties

Compound Name(2S)-N-(3-acetamidophenyl)-2-naphthalen-2-yloxypropanamide
PubChem CID42561585
Molecular FormulaC21H20N2O3
Molecular Weight348.40 g/mol
Exact Mass348.15
IUPAC Name(2S)-N-(3-acetamidophenyl)-2-naphthalen-2-yloxypropanamide
SMILESCC(=O)Nc1cccc(NC(=O)[C@H](C)Oc2ccc3ccccc3c2)c1
InChIInChI=1S/C21H20N2O3/c1-14(26-20-11-10-16-6-3-4-7-17(16)12-20)21(25)23-19-9-5-8-18(13-19)22-15(2)24/h3-14H,1-2H3,(H,22,24)(H,23,25)/t14-/m0/s1
InChIKeyBCBKLVQGVPODDA-AWEZNQCLSA-N
XLogP4.20
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.40
LogP ≤ 54.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[[(2S)-2-naphthalen-2-yloxypropanoyl]amino]benzamide
CID 95706030
(2R)-2-(4-methylphenoxy)-N-naphthalen-2-ylpropanamide
CID 837371
(2R)-N-methyl-2-naphthalen-2-yloxypropanamide
CID 42561231
(2R)-N-(3-acetamidophenyl)-2-(3,5-dimethylphenoxy)propanamide
CID 29464050
(2R)-2-(4-fluorophenoxy)-N-naphthalen-2-ylpropanamide
CID 887383
N-(3-naphthalen-2-yloxyphenyl)acetamide
CID 71156920
(2S)-N-(2,6-difluorophenyl)-2-naphthalen-2-yloxypropanamide
CID 42561465
2-naphthalen-2-yloxy-N-[4-(trifluoromethoxy)phenyl]propanamide
CID 133168907
2-(4-acetamidophenoxy)-N-(3-methoxyphenyl)propanamide
CID 4884235
2-(4-cyanophenoxy)-N-naphthalen-2-ylpropanamide
CID 78762344
(2S)-2-(4-cyanophenoxy)-N-naphthalen-2-ylpropanamide
CID 9412867
1-(3-chlorophenyl)-3-[[(2R)-2-naphthalen-2-yloxypropanoyl]amino]urea
CID 8757601

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(3-acetamidophenyl)-2-naphthalen-2-yloxypropanamide?
The IUPAC name of (2S)-N-(3-acetamidophenyl)-2-naphthalen-2-yloxypropanamide (CID 42561585) is (2S)-N-(3-acetamidophenyl)-2-naphthalen-2-yloxypropanamide.
What is the SMILES notation for (2S)-N-(3-acetamidophenyl)-2-naphthalen-2-yloxypropanamide?
The canonical SMILES for (2S)-N-(3-acetamidophenyl)-2-naphthalen-2-yloxypropanamide is CC(=O)Nc1cccc(NC(=O)[C@H](C)Oc2ccc3ccccc3c2)c1.
What is the InChIKey of (2S)-N-(3-acetamidophenyl)-2-naphthalen-2-yloxypropanamide?
The InChIKey is BCBKLVQGVPODDA-AWEZNQCLSA-N. The full InChI is InChI=1S/C21H20N2O3/c1-14(26-20-11-10-16-6-3-4-7-17(16)12-20)21(25)23-19-9-5-8-18(13-19)22-15(2)24/h3-14H,1-2H3,(H,22,24)(H,23,25)/t14-/m0/s1.
What are the key properties of (2S)-N-(3-acetamidophenyl)-2-naphthalen-2-yloxypropanamide?
(2S)-N-(3-acetamidophenyl)-2-naphthalen-2-yloxypropanamide has a molecular weight of 348.40 g/mol, XLogP of 4.20, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(3-acetamidophenyl)-2-naphthalen-2-yloxypropanamide is sourced from PubChem (CID 42561585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).