(2-morpholin-4-yl-2-oxoethyl) 1-hydroxynaphthalene-2-carboxylate

C17H17NO5 — CID 2558920

IUPAC(2-morpholin-4-yl-2-oxoethyl) 1-hydroxynaphthalene-2-carboxylate
SMILESO=C(OCC(=O)N1CCOCC1)c1ccc2ccccc2c1O
InChIInChI=1S/C17H17NO5/c19-15(18-7-9-22-10-8-18)11-23-17(21)14-6-5-12-3-1-2-4-13(12)16(14)20/h1-6,20H,7-11H2
InChIKeyOSEOKHLJGJFXFB-UHFFFAOYSA-N
MW315.32 g/mol
LogP1.56
Rot. Bonds3

About (2-morpholin-4-yl-2-oxoethyl) 1-hydroxynaphthalene-2-carboxylate

(2-morpholin-4-yl-2-oxoethyl) 1-hydroxynaphthalene-2-carboxylate (PubChem CID 2558920) has the molecular formula C17H17NO5 and a molecular weight of 315.32 g/mol. Its IUPAC name is (2-morpholin-4-yl-2-oxoethyl) 1-hydroxynaphthalene-2-carboxylate.

Molecular Properties

Compound Name(2-morpholin-4-yl-2-oxoethyl) 1-hydroxynaphthalene-2-carboxylate
PubChem CID2558920
Molecular FormulaC17H17NO5
Molecular Weight315.32 g/mol
Exact Mass315.11
IUPAC Name(2-morpholin-4-yl-2-oxoethyl) 1-hydroxynaphthalene-2-carboxylate
SMILESO=C(OCC(=O)N1CCOCC1)c1ccc2ccccc2c1O
InChIInChI=1S/C17H17NO5/c19-15(18-7-9-22-10-8-18)11-23-17(21)14-6-5-12-3-1-2-4-13(12)16(14)20/h1-6,20H,7-11H2
InChIKeyOSEOKHLJGJFXFB-UHFFFAOYSA-N
XLogP1.56
TPSA76.07 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.32
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

Xenysalate
CID 21720
(2-Morpholin-4-yl-2-oxoethyl) 2-hydroxybenzoate
CID 2094810
Biphenamine Hydrochloride
CID 21719
[2-(Cyclohexylamino)-2-oxoethyl] 3-hydroxynaphthalene-2-carboxylate
CID 2417959
[2-(2,6-Dimethylmorpholin-4-yl)-2-oxoethyl] 3-hydroxynaphthalene-2-carboxylate
CID 4126140
[2-Oxo-2-(2,2,2-trifluoroethylamino)ethyl] 1-hydroxynaphthalene-2-carboxylate
CID 4882544
Methanone, (1-hydroxy-2-naphthalenyl)-4-morpholinyl-
CID 118396
3-Hydroxy-2-naphthalenecarboxylic acid [2-(4-methyl-1-piperidinyl)-2-oxoethyl] ester
CID 2095897
3-Methoxy-2-naphthalenecarboxylic acid [2-(4-morpholinyl)-2-oxoethyl] ester
CID 2347973
(2-Oxo-2-piperidin-1-ylethyl) 3-hydroxynaphthalene-2-carboxylate
CID 2388572
[2-(2-Ethylpiperidin-1-yl)-2-oxoethyl] 3-hydroxynaphthalene-2-carboxylate
CID 2998033
3-Hydroxy-2-naphthalenecarboxylic acid [2-(3,5-dimethyl-1-piperidinyl)-2-oxoethyl] ester
CID 2999033

Frequently Asked Questions

What is the IUPAC name of (2-morpholin-4-yl-2-oxoethyl) 1-hydroxynaphthalene-2-carboxylate?
The IUPAC name of (2-morpholin-4-yl-2-oxoethyl) 1-hydroxynaphthalene-2-carboxylate (CID 2558920) is (2-morpholin-4-yl-2-oxoethyl) 1-hydroxynaphthalene-2-carboxylate.
What is the SMILES notation for (2-morpholin-4-yl-2-oxoethyl) 1-hydroxynaphthalene-2-carboxylate?
The canonical SMILES for (2-morpholin-4-yl-2-oxoethyl) 1-hydroxynaphthalene-2-carboxylate is O=C(OCC(=O)N1CCOCC1)c1ccc2ccccc2c1O.
What is the InChIKey of (2-morpholin-4-yl-2-oxoethyl) 1-hydroxynaphthalene-2-carboxylate?
The InChIKey is OSEOKHLJGJFXFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO5/c19-15(18-7-9-22-10-8-18)11-23-17(21)14-6-5-12-3-1-2-4-13(12)16(14)20/h1-6,20H,7-11H2.
What are the key properties of (2-morpholin-4-yl-2-oxoethyl) 1-hydroxynaphthalene-2-carboxylate?
(2-morpholin-4-yl-2-oxoethyl) 1-hydroxynaphthalene-2-carboxylate has a molecular weight of 315.32 g/mol, XLogP of 1.56, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-morpholin-4-yl-2-oxoethyl) 1-hydroxynaphthalene-2-carboxylate is sourced from PubChem (CID 2558920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).