N-[6-(hydroxymethyl)naphthalen-2-yl]acetamide

C13H13NO2 — CID 71416086

IUPACN-[6-(hydroxymethyl)naphthalen-2-yl]acetamide
SMILESCC(=O)Nc1ccc2cc(CO)ccc2c1
InChIInChI=1S/C13H13NO2/c1-9(16)14-13-5-4-11-6-10(8-15)2-3-12(11)7-13/h2-7,15H,8H2,1H3,(H,14,16)
InChIKeyBRQKOIHDILSFPX-UHFFFAOYSA-N
MW215.25 g/mol
LogP2.29
Rot. Bonds2

About N-[6-(hydroxymethyl)naphthalen-2-yl]acetamide

N-[6-(hydroxymethyl)naphthalen-2-yl]acetamide (PubChem CID 71416086) has the molecular formula C13H13NO2 and a molecular weight of 215.25 g/mol. Its IUPAC name is N-[6-(hydroxymethyl)naphthalen-2-yl]acetamide.

Molecular Properties

Compound NameN-[6-(hydroxymethyl)naphthalen-2-yl]acetamide
PubChem CID71416086
Molecular FormulaC13H13NO2
Molecular Weight215.25 g/mol
Exact Mass215.09
IUPAC NameN-[6-(hydroxymethyl)naphthalen-2-yl]acetamide
SMILESCC(=O)Nc1ccc2cc(CO)ccc2c1
InChIInChI=1S/C13H13NO2/c1-9(16)14-13-5-4-11-6-10(8-15)2-3-12(11)7-13/h2-7,15H,8H2,1H3,(H,14,16)
InChIKeyBRQKOIHDILSFPX-UHFFFAOYSA-N
XLogP2.29
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

[6-(hydroxymethyl)naphthalen-2-yl]methanol
CID 11788722
N-(4-acetamidophenyl)-2-naphthalen-2-ylacetamide
CID 26499620
N-[4-(2-hydroxyethyl)phenyl]acetamide
CID 3295905
N-[3-hydroxy-4-(hydroxymethyl)phenyl]acetamide
CID 162349141
[2-(naphthalen-2-ylamino)-2-oxoethyl] 2-(4-acetamidophenyl)acetate
CID 8608400
2-[(6-acetamidonaphthalen-2-yl)sulfonylamino]acetic acid
CID 14457729
[2-acetamido-5-(hydroxymethyl)phenyl]methylphosphonic acid
CID 126482437
2-bromo-N-[6-[(2-bromoacetyl)amino]naphthalen-2-yl]acetamide
CID 146415877
N-[3-(hydroxymethyl)-4-methoxyphenyl]acetamide
CID 82469130
N-[2-[2-hydroxyethyl(methyl)amino]quinolin-6-yl]acetamide
CID 45267437
4-ethyl-N-naphthalen-2-ylbenzamide
CID 5108081
1-[6-(2-hydroxyethylamino)naphthalen-2-yl]ethanone
CID 71475376

Frequently Asked Questions

What is the IUPAC name of N-[6-(hydroxymethyl)naphthalen-2-yl]acetamide?
The IUPAC name of N-[6-(hydroxymethyl)naphthalen-2-yl]acetamide (CID 71416086) is N-[6-(hydroxymethyl)naphthalen-2-yl]acetamide.
What is the SMILES notation for N-[6-(hydroxymethyl)naphthalen-2-yl]acetamide?
The canonical SMILES for N-[6-(hydroxymethyl)naphthalen-2-yl]acetamide is CC(=O)Nc1ccc2cc(CO)ccc2c1.
What is the InChIKey of N-[6-(hydroxymethyl)naphthalen-2-yl]acetamide?
The InChIKey is BRQKOIHDILSFPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NO2/c1-9(16)14-13-5-4-11-6-10(8-15)2-3-12(11)7-13/h2-7,15H,8H2,1H3,(H,14,16).
What are the key properties of N-[6-(hydroxymethyl)naphthalen-2-yl]acetamide?
N-[6-(hydroxymethyl)naphthalen-2-yl]acetamide has a molecular weight of 215.25 g/mol, XLogP of 2.29, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(hydroxymethyl)naphthalen-2-yl]acetamide is sourced from PubChem (CID 71416086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).