2-[6-(acetamidomethyl)naphthalen-2-yl]oxy-N-(2-hydroxyethyl)acetamide

C17H20N2O4 — CID 54108187

IUPAC2-[6-(acetamidomethyl)naphthalen-2-yl]oxy-N-(2-hydroxyethyl)acetamide
SMILESCC(=O)NCc1ccc2cc(OCC(=O)NCCO)ccc2c1
InChIInChI=1S/C17H20N2O4/c1-12(21)19-10-13-2-3-15-9-16(5-4-14(15)8-13)23-11-17(22)18-6-7-20/h2-5,8-9,20H,6-7,10-11H2,1H3,(H,18,22)(H,19,21)
InChIKeyNFFXEJRDSSKBBF-UHFFFAOYSA-N
MW316.36 g/mol
LogP0.96
Rot. Bonds7

About 2-[6-(acetamidomethyl)naphthalen-2-yl]oxy-N-(2-hydroxyethyl)acetamide

2-[6-(acetamidomethyl)naphthalen-2-yl]oxy-N-(2-hydroxyethyl)acetamide (PubChem CID 54108187) has the molecular formula C17H20N2O4 and a molecular weight of 316.36 g/mol. Its IUPAC name is 2-[6-(acetamidomethyl)naphthalen-2-yl]oxy-N-(2-hydroxyethyl)acetamide.

Molecular Properties

Compound Name2-[6-(acetamidomethyl)naphthalen-2-yl]oxy-N-(2-hydroxyethyl)acetamide
PubChem CID54108187
Molecular FormulaC17H20N2O4
Molecular Weight316.36 g/mol
Exact Mass316.14
IUPAC Name2-[6-(acetamidomethyl)naphthalen-2-yl]oxy-N-(2-hydroxyethyl)acetamide
SMILESCC(=O)NCc1ccc2cc(OCC(=O)NCCO)ccc2c1
InChIInChI=1S/C17H20N2O4/c1-12(21)19-10-13-2-3-15-9-16(5-4-14(15)8-13)23-11-17(22)18-6-7-20/h2-5,8-9,20H,6-7,10-11H2,1H3,(H,18,22)(H,19,21)
InChIKeyNFFXEJRDSSKBBF-UHFFFAOYSA-N
XLogP0.96
TPSA87.66 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.36
LogP ≤ 50.96
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-acetamidoethyl)-2-naphthalen-2-yloxyacetamide
CID 7942082
1-(2-hydroxyethyl)-3-[(6-methoxynaphthalen-2-yl)methyl]urea
CID 110894111
2-(3-acetylphenoxy)-N-[(6-methoxynaphthalen-2-yl)methyl]acetamide
CID 30307790
N-(2-hydroxyethyl)-2-[4-[(E)-2-[4-[2-(2-hydroxyethylamino)-2-oxoethoxy]phenyl]ethenyl]phenoxy]acetamide
CID 134394160
4-(acetamidomethyl)-N-[(6-methoxynaphthalen-2-yl)methyl]benzamide
CID 17454314
N-(2-hydroxyethyl)-2-(4-methylsulfanylphenoxy)acetamide
CID 63648820
N-[(3,5-dimethoxyphenyl)methyl]-2-naphthalen-2-yloxyacetamide
CID 55577770
2-(6-bromonaphthalen-2-yl)oxy-N-[(4-chlorophenyl)methyl]acetamide
CID 7786789
N-(2-methoxyethyl)-2-[(2-naphthalen-2-yloxyacetyl)amino]acetamide
CID 24517119
N-[(4-methoxyphenyl)methyl]acetamide;hydrochloride
CID 139808929
N-[(2-methoxy-4-pyridinyl)methyl]-2-naphthalen-2-yloxyacetamide
CID 18167335
N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-2-naphthalen-2-yloxyacetamide
CID 26678252

Frequently Asked Questions

What is the IUPAC name of 2-[6-(acetamidomethyl)naphthalen-2-yl]oxy-N-(2-hydroxyethyl)acetamide?
The IUPAC name of 2-[6-(acetamidomethyl)naphthalen-2-yl]oxy-N-(2-hydroxyethyl)acetamide (CID 54108187) is 2-[6-(acetamidomethyl)naphthalen-2-yl]oxy-N-(2-hydroxyethyl)acetamide.
What is the SMILES notation for 2-[6-(acetamidomethyl)naphthalen-2-yl]oxy-N-(2-hydroxyethyl)acetamide?
The canonical SMILES for 2-[6-(acetamidomethyl)naphthalen-2-yl]oxy-N-(2-hydroxyethyl)acetamide is CC(=O)NCc1ccc2cc(OCC(=O)NCCO)ccc2c1.
What is the InChIKey of 2-[6-(acetamidomethyl)naphthalen-2-yl]oxy-N-(2-hydroxyethyl)acetamide?
The InChIKey is NFFXEJRDSSKBBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O4/c1-12(21)19-10-13-2-3-15-9-16(5-4-14(15)8-13)23-11-17(22)18-6-7-20/h2-5,8-9,20H,6-7,10-11H2,1H3,(H,18,22)(H,19,21).
What are the key properties of 2-[6-(acetamidomethyl)naphthalen-2-yl]oxy-N-(2-hydroxyethyl)acetamide?
2-[6-(acetamidomethyl)naphthalen-2-yl]oxy-N-(2-hydroxyethyl)acetamide has a molecular weight of 316.36 g/mol, XLogP of 0.96, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(acetamidomethyl)naphthalen-2-yl]oxy-N-(2-hydroxyethyl)acetamide is sourced from PubChem (CID 54108187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).