N-methyl-N-[(6-methylnaphthalen-2-yl)methyl]-2-oxoacetamide

C15H15NO2 — CID 115166473

IUPACN-methyl-N-[(6-methylnaphthalen-2-yl)methyl]-2-oxoacetamide
SMILESCc1ccc2cc(CN(C)C(=O)C=O)ccc2c1
InChIInChI=1S/C15H15NO2/c1-11-3-5-14-8-12(4-6-13(14)7-11)9-16(2)15(18)10-17/h3-8,10H,9H2,1-2H3
InChIKeyMCINJLCBPDNYGU-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.31
Rot. Bonds3

About N-methyl-N-[(6-methylnaphthalen-2-yl)methyl]-2-oxoacetamide

N-methyl-N-[(6-methylnaphthalen-2-yl)methyl]-2-oxoacetamide (PubChem CID 115166473) has the molecular formula C15H15NO2 and a molecular weight of 241.29 g/mol. Its IUPAC name is N-methyl-N-[(6-methylnaphthalen-2-yl)methyl]-2-oxoacetamide.

Molecular Properties

Compound NameN-methyl-N-[(6-methylnaphthalen-2-yl)methyl]-2-oxoacetamide
PubChem CID115166473
Molecular FormulaC15H15NO2
Molecular Weight241.29 g/mol
Exact Mass241.11
IUPAC NameN-methyl-N-[(6-methylnaphthalen-2-yl)methyl]-2-oxoacetamide
SMILESCc1ccc2cc(CN(C)C(=O)C=O)ccc2c1
InChIInChI=1S/C15H15NO2/c1-11-3-5-14-8-12(4-6-13(14)7-11)9-16(2)15(18)10-17/h3-8,10H,9H2,1-2H3
InChIKeyMCINJLCBPDNYGU-UHFFFAOYSA-N
XLogP2.31
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 52.31
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

N-[(3,4-dimethylphenyl)methyl]-N-methyl-2-oxoacetamide
CID 115166333
2-chloro-N-methyl-N-[(6-methylnaphthalen-2-yl)methyl]acetamide
CID 115162099
N-[(3-chloro-4-fluorophenyl)methyl]-N-methyl-2-oxoacetamide
CID 115166420
N-methyl-N-(naphthalen-2-ylmethyl)prop-2-enamide
CID 54874632
N-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylmethyl)-N-methyl-2-oxoacetamide
CID 115166358
N-[(4-methoxy-3-propan-2-ylphenyl)methyl]-N-methyl-2-oxoacetamide
CID 115166361
2-hydroxy-N-methyl-N-[2-(6-methylnaphthalen-2-yl)ethyl]acetamide
CID 115140233
2-(6-methylnaphthalen-2-yl)acetic acid
CID 13199360
methyl-[(6-methylnaphthalen-2-yl)methyl]cyanamide
CID 117043418
(E)-4-[methyl-[(3-methylphenyl)methyl]amino]-4-oxobut-2-enoic acid
CID 54875189
N-methyl-N-[2-(3-methylphenyl)ethyl]-2-oxoacetamide
CID 115166756
N-[(4-butan-2-ylphenyl)methyl]-N-methyl-2-oxoacetamide
CID 115166354

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(6-methylnaphthalen-2-yl)methyl]-2-oxoacetamide?
The IUPAC name of N-methyl-N-[(6-methylnaphthalen-2-yl)methyl]-2-oxoacetamide (CID 115166473) is N-methyl-N-[(6-methylnaphthalen-2-yl)methyl]-2-oxoacetamide.
What is the SMILES notation for N-methyl-N-[(6-methylnaphthalen-2-yl)methyl]-2-oxoacetamide?
The canonical SMILES for N-methyl-N-[(6-methylnaphthalen-2-yl)methyl]-2-oxoacetamide is Cc1ccc2cc(CN(C)C(=O)C=O)ccc2c1.
What is the InChIKey of N-methyl-N-[(6-methylnaphthalen-2-yl)methyl]-2-oxoacetamide?
The InChIKey is MCINJLCBPDNYGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO2/c1-11-3-5-14-8-12(4-6-13(14)7-11)9-16(2)15(18)10-17/h3-8,10H,9H2,1-2H3.
What are the key properties of N-methyl-N-[(6-methylnaphthalen-2-yl)methyl]-2-oxoacetamide?
N-methyl-N-[(6-methylnaphthalen-2-yl)methyl]-2-oxoacetamide has a molecular weight of 241.29 g/mol, XLogP of 2.31, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(6-methylnaphthalen-2-yl)methyl]-2-oxoacetamide is sourced from PubChem (CID 115166473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).