N-[(4-hydroxyphenyl)methyl]-N-methyl-2-naphthalen-2-yloxyacetamide

C20H19NO3 — CID 51114602

IUPACN-[(4-hydroxyphenyl)methyl]-N-methyl-2-naphthalen-2-yloxyacetamide
SMILESCN(Cc1ccc(O)cc1)C(=O)COc1ccc2ccccc2c1
InChIInChI=1S/C20H19NO3/c1-21(13-15-6-9-18(22)10-7-15)20(23)14-24-19-11-8-16-4-2-3-5-17(16)12-19/h2-12,22H,13-14H2,1H3
InChIKeyKZCUTXXXOYINPY-UHFFFAOYSA-N
MW321.38 g/mol
LogP3.58
Rot. Bonds5

About N-[(4-hydroxyphenyl)methyl]-N-methyl-2-naphthalen-2-yloxyacetamide

N-[(4-hydroxyphenyl)methyl]-N-methyl-2-naphthalen-2-yloxyacetamide (PubChem CID 51114602) has the molecular formula C20H19NO3 and a molecular weight of 321.38 g/mol. Its IUPAC name is N-[(4-hydroxyphenyl)methyl]-N-methyl-2-naphthalen-2-yloxyacetamide.

Molecular Properties

Compound NameN-[(4-hydroxyphenyl)methyl]-N-methyl-2-naphthalen-2-yloxyacetamide
PubChem CID51114602
Molecular FormulaC20H19NO3
Molecular Weight321.38 g/mol
Exact Mass321.14
IUPAC NameN-[(4-hydroxyphenyl)methyl]-N-methyl-2-naphthalen-2-yloxyacetamide
SMILESCN(Cc1ccc(O)cc1)C(=O)COc1ccc2ccccc2c1
InChIInChI=1S/C20H19NO3/c1-21(13-15-6-9-18(22)10-7-15)20(23)14-24-19-11-8-16-4-2-3-5-17(16)12-19/h2-12,22H,13-14H2,1H3
InChIKeyKZCUTXXXOYINPY-UHFFFAOYSA-N
XLogP3.58
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-2-naphthalen-2-yloxyacetamide
CID 26072019
N-methyl-2-[(2-methylpropan-2-yl)oxy]-N-(naphthalen-2-ylmethyl)acetamide
CID 115950185
N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-2-naphthalen-2-yloxyacetamide
CID 7670189
N-[(2,3-dichlorophenyl)methyl]-N-methyl-2-naphthalen-2-yloxyacetamide
CID 7930348
N-[(2-methoxy-5-methylphenyl)methyl]-N-methyl-2-naphthalen-2-yloxyacetamide
CID 9469697
N-methyl-2-naphthalen-2-yloxy-N-[(2,3,4-trimethoxyphenyl)methyl]acetamide
CID 26555249
2-(3-fluorophenoxy)-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylacetamide
CID 9482694
N-benzyl-2-(3-fluorophenoxy)-N-methylacetamide
CID 110755450
2-(2-methoxyethoxy)-N-methyl-N-(naphthalen-2-ylmethyl)acetamide
CID 103601960
2-[4-[[methyl(naphthalene-2-carbonyl)amino]methyl]phenoxy]acetic acid
CID 138043891
[2-[methyl-[(2-methylphenyl)methyl]amino]-2-oxoethyl] 2-naphthalen-2-yloxyacetate
CID 7843353
N-methyl-2-naphthalen-2-yloxy-N-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]acetamide
CID 8874641

Frequently Asked Questions

What is the IUPAC name of N-[(4-hydroxyphenyl)methyl]-N-methyl-2-naphthalen-2-yloxyacetamide?
The IUPAC name of N-[(4-hydroxyphenyl)methyl]-N-methyl-2-naphthalen-2-yloxyacetamide (CID 51114602) is N-[(4-hydroxyphenyl)methyl]-N-methyl-2-naphthalen-2-yloxyacetamide.
What is the SMILES notation for N-[(4-hydroxyphenyl)methyl]-N-methyl-2-naphthalen-2-yloxyacetamide?
The canonical SMILES for N-[(4-hydroxyphenyl)methyl]-N-methyl-2-naphthalen-2-yloxyacetamide is CN(Cc1ccc(O)cc1)C(=O)COc1ccc2ccccc2c1.
What is the InChIKey of N-[(4-hydroxyphenyl)methyl]-N-methyl-2-naphthalen-2-yloxyacetamide?
The InChIKey is KZCUTXXXOYINPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19NO3/c1-21(13-15-6-9-18(22)10-7-15)20(23)14-24-19-11-8-16-4-2-3-5-17(16)12-19/h2-12,22H,13-14H2,1H3.
What are the key properties of N-[(4-hydroxyphenyl)methyl]-N-methyl-2-naphthalen-2-yloxyacetamide?
N-[(4-hydroxyphenyl)methyl]-N-methyl-2-naphthalen-2-yloxyacetamide has a molecular weight of 321.38 g/mol, XLogP of 3.58, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-hydroxyphenyl)methyl]-N-methyl-2-naphthalen-2-yloxyacetamide is sourced from PubChem (CID 51114602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).