N-[3-[(2-methoxyacetyl)amino]phenyl]-2-naphthalen-2-ylacetamide

C21H20N2O3 — CID 46671357

IUPACN-[3-[(2-methoxyacetyl)amino]phenyl]-2-naphthalen-2-ylacetamide
SMILESCOCC(=O)Nc1cccc(NC(=O)Cc2ccc3ccccc3c2)c1
InChIInChI=1S/C21H20N2O3/c1-26-14-21(25)23-19-8-4-7-18(13-19)22-20(24)12-15-9-10-16-5-2-3-6-17(16)11-15/h2-11,13H,12,14H2,1H3,(H,22,24)(H,23,25)
InChIKeyJBMDEJCRQSTNNM-UHFFFAOYSA-N
MW348.40 g/mol
LogP3.61
Rot. Bonds6

About N-[3-[(2-methoxyacetyl)amino]phenyl]-2-naphthalen-2-ylacetamide

N-[3-[(2-methoxyacetyl)amino]phenyl]-2-naphthalen-2-ylacetamide (PubChem CID 46671357) has the molecular formula C21H20N2O3 and a molecular weight of 348.40 g/mol. Its IUPAC name is N-[3-[(2-methoxyacetyl)amino]phenyl]-2-naphthalen-2-ylacetamide.

Molecular Properties

Compound NameN-[3-[(2-methoxyacetyl)amino]phenyl]-2-naphthalen-2-ylacetamide
PubChem CID46671357
Molecular FormulaC21H20N2O3
Molecular Weight348.40 g/mol
Exact Mass348.15
IUPAC NameN-[3-[(2-methoxyacetyl)amino]phenyl]-2-naphthalen-2-ylacetamide
SMILESCOCC(=O)Nc1cccc(NC(=O)Cc2ccc3ccccc3c2)c1
InChIInChI=1S/C21H20N2O3/c1-26-14-21(25)23-19-8-4-7-18(13-19)22-20(24)12-15-9-10-16-5-2-3-6-17(16)11-15/h2-11,13H,12,14H2,1H3,(H,22,24)(H,23,25)
InChIKeyJBMDEJCRQSTNNM-UHFFFAOYSA-N
XLogP3.61
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.40
LogP ≤ 53.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3,5-bis[(2-naphthalen-2-ylacetyl)amino]phenyl]-2-naphthalen-2-ylacetamide
CID 67257199
N-(3-acetylphenyl)-2-naphthalen-2-ylacetamide
CID 9165110
N-(3-hydroxyphenyl)-2-naphthalen-2-ylacetamide
CID 28739776
N-(4-acetamidophenyl)-2-naphthalen-2-ylacetamide
CID 26499620
[2-(3-methylsulfanylanilino)-2-oxoethyl] 2-naphthalen-2-ylacetate
CID 33279450
N-(4-methylphenyl)-2-naphthalen-2-ylacetamide
CID 9411639
2-naphthalen-2-yl-N-pyridin-4-ylacetamide
CID 25336159
N-(4-ethoxyphenyl)-2-naphthalen-2-ylacetamide
CID 2992988
N-(4-acetylphenyl)-2-naphthalen-2-ylacetamide
CID 16849660
N-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]propanamide
CID 807123
[2-(3,5-dimethylanilino)-2-oxoethyl] 2-naphthalen-2-ylacetate
CID 7828719
2-[4-[(2-naphthalen-2-ylacetyl)amino]phenyl]acetic acid
CID 6461297

Frequently Asked Questions

What is the IUPAC name of N-[3-[(2-methoxyacetyl)amino]phenyl]-2-naphthalen-2-ylacetamide?
The IUPAC name of N-[3-[(2-methoxyacetyl)amino]phenyl]-2-naphthalen-2-ylacetamide (CID 46671357) is N-[3-[(2-methoxyacetyl)amino]phenyl]-2-naphthalen-2-ylacetamide.
What is the SMILES notation for N-[3-[(2-methoxyacetyl)amino]phenyl]-2-naphthalen-2-ylacetamide?
The canonical SMILES for N-[3-[(2-methoxyacetyl)amino]phenyl]-2-naphthalen-2-ylacetamide is COCC(=O)Nc1cccc(NC(=O)Cc2ccc3ccccc3c2)c1.
What is the InChIKey of N-[3-[(2-methoxyacetyl)amino]phenyl]-2-naphthalen-2-ylacetamide?
The InChIKey is JBMDEJCRQSTNNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O3/c1-26-14-21(25)23-19-8-4-7-18(13-19)22-20(24)12-15-9-10-16-5-2-3-6-17(16)11-15/h2-11,13H,12,14H2,1H3,(H,22,24)(H,23,25).
What are the key properties of N-[3-[(2-methoxyacetyl)amino]phenyl]-2-naphthalen-2-ylacetamide?
N-[3-[(2-methoxyacetyl)amino]phenyl]-2-naphthalen-2-ylacetamide has a molecular weight of 348.40 g/mol, XLogP of 3.61, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(2-methoxyacetyl)amino]phenyl]-2-naphthalen-2-ylacetamide is sourced from PubChem (CID 46671357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).