N-hydroxy-N-[1-(6-methoxynaphthalen-2-yl)ethyl]acetamide

C15H17NO3 — CID 57042086

IUPACN-hydroxy-N-[1-(6-methoxynaphthalen-2-yl)ethyl]acetamide
SMILESCOc1ccc2cc(C(C)N(O)C(C)=O)ccc2c1
InChIInChI=1S/C15H17NO3/c1-10(16(18)11(2)17)12-4-5-14-9-15(19-3)7-6-13(14)8-12/h4-10,18H,1-3H3
InChIKeyVKZBTWWXDHCUDG-UHFFFAOYSA-N
MW259.31 g/mol
LogP3.15
Rot. Bonds3

About N-hydroxy-N-[1-(6-methoxynaphthalen-2-yl)ethyl]acetamide

N-hydroxy-N-[1-(6-methoxynaphthalen-2-yl)ethyl]acetamide (PubChem CID 57042086) has the molecular formula C15H17NO3 and a molecular weight of 259.31 g/mol. Its IUPAC name is N-hydroxy-N-[1-(6-methoxynaphthalen-2-yl)ethyl]acetamide.

Molecular Properties

Compound NameN-hydroxy-N-[1-(6-methoxynaphthalen-2-yl)ethyl]acetamide
PubChem CID57042086
Molecular FormulaC15H17NO3
Molecular Weight259.31 g/mol
Exact Mass259.12
IUPAC NameN-hydroxy-N-[1-(6-methoxynaphthalen-2-yl)ethyl]acetamide
SMILESCOc1ccc2cc(C(C)N(O)C(C)=O)ccc2c1
InChIInChI=1S/C15H17NO3/c1-10(16(18)11(2)17)12-4-5-14-9-15(19-3)7-6-13(14)8-12/h4-10,18H,1-3H3
InChIKeyVKZBTWWXDHCUDG-UHFFFAOYSA-N
XLogP3.15
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3-(6-methoxynaphthalen-2-yl)butan-2-one
CID 13292512
magnesium;hydride;2-(6-methoxynaphthalen-2-yl)propanoic acid
CID 174047871
potassium;hydride;2-(6-methoxynaphthalen-2-yl)propanoic acid
CID 174215246
(2R)-2-(7-methoxynaphthalen-2-yl)propanoic acid
CID 93477602
sodium;hydride;2-(6-methoxynaphthalen-2-yl)propanoic acid
CID 173070735
1-(6-methoxynaphthalen-2-yl)-1-(methylamino)propan-2-one
CID 116955950
(2S)-N-hydroxy-2-(6-methoxynaphthalen-2-yl)propanamide
CID 92850098
chloro (2S)-2-(6-methoxynaphthalen-2-yl)propanoate
CID 90693422
methyl 2-amino-2-(6-methoxynaphthalen-2-yl)acetate
CID 54022420
2-(6-methoxynaphthalen-2-yl)-4-methylpentan-3-ol
CID 79298435
4-(6-methoxynaphthalen-2-yl)-2-oxopentanoic acid
CID 177255800
[(2S)-2-(6-methoxynaphthalen-2-yl)propyl] 2-methylpropanoate
CID 141195522

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-N-[1-(6-methoxynaphthalen-2-yl)ethyl]acetamide?
The IUPAC name of N-hydroxy-N-[1-(6-methoxynaphthalen-2-yl)ethyl]acetamide (CID 57042086) is N-hydroxy-N-[1-(6-methoxynaphthalen-2-yl)ethyl]acetamide.
What is the SMILES notation for N-hydroxy-N-[1-(6-methoxynaphthalen-2-yl)ethyl]acetamide?
The canonical SMILES for N-hydroxy-N-[1-(6-methoxynaphthalen-2-yl)ethyl]acetamide is COc1ccc2cc(C(C)N(O)C(C)=O)ccc2c1.
What is the InChIKey of N-hydroxy-N-[1-(6-methoxynaphthalen-2-yl)ethyl]acetamide?
The InChIKey is VKZBTWWXDHCUDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO3/c1-10(16(18)11(2)17)12-4-5-14-9-15(19-3)7-6-13(14)8-12/h4-10,18H,1-3H3.
What are the key properties of N-hydroxy-N-[1-(6-methoxynaphthalen-2-yl)ethyl]acetamide?
N-hydroxy-N-[1-(6-methoxynaphthalen-2-yl)ethyl]acetamide has a molecular weight of 259.31 g/mol, XLogP of 3.15, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-N-[1-(6-methoxynaphthalen-2-yl)ethyl]acetamide is sourced from PubChem (CID 57042086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).