N-methyl-N-naphthalen-1-yl-2-oxoacetamide

C13H11NO2 — CID 115166156

IUPACN-methyl-N-naphthalen-1-yl-2-oxoacetamide
SMILESCN(C(=O)C=O)c1cccc2ccccc12
InChIInChI=1S/C13H11NO2/c1-14(13(16)9-15)12-8-4-6-10-5-2-3-7-11(10)12/h2-9H,1H3
InChIKeyROMLGOHEVBDHEK-UHFFFAOYSA-N
MW213.24 g/mol
LogP2.00
Rot. Bonds2

About N-methyl-N-naphthalen-1-yl-2-oxoacetamide

N-methyl-N-naphthalen-1-yl-2-oxoacetamide (PubChem CID 115166156) has the molecular formula C13H11NO2 and a molecular weight of 213.24 g/mol. Its IUPAC name is N-methyl-N-naphthalen-1-yl-2-oxoacetamide.

Molecular Properties

Compound NameN-methyl-N-naphthalen-1-yl-2-oxoacetamide
PubChem CID115166156
Molecular FormulaC13H11NO2
Molecular Weight213.24 g/mol
Exact Mass213.08
IUPAC NameN-methyl-N-naphthalen-1-yl-2-oxoacetamide
SMILESCN(C(=O)C=O)c1cccc2ccccc12
InChIInChI=1S/C13H11NO2/c1-14(13(16)9-15)12-8-4-6-10-5-2-3-7-11(10)12/h2-9H,1H3
InChIKeyROMLGOHEVBDHEK-UHFFFAOYSA-N
XLogP2.00
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.24
LogP ≤ 52.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

2-hydroxy-N-methyl-N-naphthalen-1-ylacetamide
CID 115139787
N-methyl-N-naphthalen-1-ylbenzamide
CID 47382605
1,3-dimethyl-1-naphthalen-1-yl-3-phenylurea
CID 11403549
3-amino-1-methyl-1-naphthalen-1-ylurea
CID 115192586
propyl N-methyl-N-naphthalen-1-ylcarbamate
CID 71338053
N,N-dimethylnaphthalen-1-amine;hydroxylamine
CID 135773162
N,N-dimethylnaphthalen-1-amine;sulfuric acid
CID 159908177
1,3-dimethyl-1-naphthalen-1-yl-3-[(1S)-1-phenylethyl]urea
CID 102087616
2-(cyclopropylamino)-N-methyl-N-naphthalen-1-ylacetamide
CID 115158418
3-ethyl-N-methyl-N-naphthalen-1-ylbenzamide
CID 90124264
methyl N-methoxycarbonyl-N-naphthalen-1-ylcarbamate
CID 138084079
N-ethenyl-N-methylnaphthalen-1-amine
CID 70602093

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-naphthalen-1-yl-2-oxoacetamide?
The IUPAC name of N-methyl-N-naphthalen-1-yl-2-oxoacetamide (CID 115166156) is N-methyl-N-naphthalen-1-yl-2-oxoacetamide.
What is the SMILES notation for N-methyl-N-naphthalen-1-yl-2-oxoacetamide?
The canonical SMILES for N-methyl-N-naphthalen-1-yl-2-oxoacetamide is CN(C(=O)C=O)c1cccc2ccccc12.
What is the InChIKey of N-methyl-N-naphthalen-1-yl-2-oxoacetamide?
The InChIKey is ROMLGOHEVBDHEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11NO2/c1-14(13(16)9-15)12-8-4-6-10-5-2-3-7-11(10)12/h2-9H,1H3.
What are the key properties of N-methyl-N-naphthalen-1-yl-2-oxoacetamide?
N-methyl-N-naphthalen-1-yl-2-oxoacetamide has a molecular weight of 213.24 g/mol, XLogP of 2.00, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-naphthalen-1-yl-2-oxoacetamide is sourced from PubChem (CID 115166156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).