5-ethyl-2-hydroxy-N-[(2R)-oxan-2-yl]oxybenzamide

C14H19NO4 — CID 95301604

IUPAC5-ethyl-2-hydroxy-N-[(2R)-oxan-2-yl]oxybenzamide
SMILESCCc1ccc(O)c(C(=O)NO[C@@H]2CCCCO2)c1
InChIInChI=1S/C14H19NO4/c1-2-10-6-7-12(16)11(9-10)14(17)15-19-13-5-3-4-8-18-13/h6-7,9,13,16H,2-5,8H2,1H3,(H,15,17)/t13-/m1/s1
InChIKeyXNFYEMWXHWTDMT-CYBMUJFWSA-N
MW265.31 g/mol
LogP2.14
Rot. Bonds4

About 5-ethyl-2-hydroxy-N-[(2R)-oxan-2-yl]oxybenzamide

5-ethyl-2-hydroxy-N-[(2R)-oxan-2-yl]oxybenzamide (PubChem CID 95301604) has the molecular formula C14H19NO4 and a molecular weight of 265.31 g/mol. Its IUPAC name is 5-ethyl-2-hydroxy-N-[(2R)-oxan-2-yl]oxybenzamide.

Molecular Properties

Compound Name5-ethyl-2-hydroxy-N-[(2R)-oxan-2-yl]oxybenzamide
PubChem CID95301604
Molecular FormulaC14H19NO4
Molecular Weight265.31 g/mol
Exact Mass265.13
IUPAC Name5-ethyl-2-hydroxy-N-[(2R)-oxan-2-yl]oxybenzamide
SMILESCCc1ccc(O)c(C(=O)NO[C@@H]2CCCCO2)c1
InChIInChI=1S/C14H19NO4/c1-2-10-6-7-12(16)11(9-10)14(17)15-19-13-5-3-4-8-18-13/h6-7,9,13,16H,2-5,8H2,1H3,(H,15,17)/t13-/m1/s1
InChIKeyXNFYEMWXHWTDMT-CYBMUJFWSA-N
XLogP2.14
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

5-ethyl-N-(oxan-2-yloxy)furan-2-carboxamide
CID 60613092
2,4-difluoro-N-[(2R)-oxan-2-yl]oxybenzamide
CID 94817259
4-chloro-2-fluoro-N-[(2S)-oxan-2-yl]oxybenzamide
CID 52828159
2-(4-methoxyphenyl)-N-[(2R)-oxan-2-yl]oxyacetamide
CID 94817277
3-[[(S)-methylsulfinyl]methyl]-N-[(2S)-oxan-2-yl]oxybenzamide
CID 95156522
4-chloro-N-(oxan-2-yloxy)benzamide
CID 51103118
N-(oxan-2-yloxy)-2-[(4-phenylphenyl)methylsulfonyl]benzamide
CID 10182459
N-[(2R)-oxan-2-yl]oxy-1-propylindole-3-carboxamide
CID 99792755
3,4,5-trimethoxy-N-(oxan-2-yloxy)benzamide
CID 51103131
3-(dimethylamino)-N-(oxan-2-yloxy)benzamide
CID 60612522
N-(oxan-2-yloxy)-2-phenoxybenzamide
CID 60612521
4-bromo-3,5-dimethoxy-N-[(2R)-oxan-2-yl]oxybenzamide
CID 52829220

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2-hydroxy-N-[(2R)-oxan-2-yl]oxybenzamide?
The IUPAC name of 5-ethyl-2-hydroxy-N-[(2R)-oxan-2-yl]oxybenzamide (CID 95301604) is 5-ethyl-2-hydroxy-N-[(2R)-oxan-2-yl]oxybenzamide.
What is the SMILES notation for 5-ethyl-2-hydroxy-N-[(2R)-oxan-2-yl]oxybenzamide?
The canonical SMILES for 5-ethyl-2-hydroxy-N-[(2R)-oxan-2-yl]oxybenzamide is CCc1ccc(O)c(C(=O)NO[C@@H]2CCCCO2)c1.
What is the InChIKey of 5-ethyl-2-hydroxy-N-[(2R)-oxan-2-yl]oxybenzamide?
The InChIKey is XNFYEMWXHWTDMT-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H19NO4/c1-2-10-6-7-12(16)11(9-10)14(17)15-19-13-5-3-4-8-18-13/h6-7,9,13,16H,2-5,8H2,1H3,(H,15,17)/t13-/m1/s1.
What are the key properties of 5-ethyl-2-hydroxy-N-[(2R)-oxan-2-yl]oxybenzamide?
5-ethyl-2-hydroxy-N-[(2R)-oxan-2-yl]oxybenzamide has a molecular weight of 265.31 g/mol, XLogP of 2.14, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2-hydroxy-N-[(2R)-oxan-2-yl]oxybenzamide is sourced from PubChem (CID 95301604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).