N-(oxan-3-yl)-2-phenoxyacetamide

C13H17NO3 — CID 142540024

IUPACN-(oxan-3-yl)-2-phenoxyacetamide
SMILESO=C(COc1ccccc1)NC1CCCOC1
InChIInChI=1S/C13H17NO3/c15-13(14-11-5-4-8-16-9-11)10-17-12-6-2-1-3-7-12/h1-3,6-7,11H,4-5,8-10H2,(H,14,15)
InChIKeyDSPDSKCGASPFLQ-UHFFFAOYSA-N
MW235.28 g/mol
LogP1.36
Rot. Bonds4

About N-(oxan-3-yl)-2-phenoxyacetamide

N-(oxan-3-yl)-2-phenoxyacetamide (PubChem CID 142540024) has the molecular formula C13H17NO3 and a molecular weight of 235.28 g/mol. Its IUPAC name is N-(oxan-3-yl)-2-phenoxyacetamide.

Molecular Properties

Compound NameN-(oxan-3-yl)-2-phenoxyacetamide
PubChem CID142540024
Molecular FormulaC13H17NO3
Molecular Weight235.28 g/mol
Exact Mass235.12
IUPAC NameN-(oxan-3-yl)-2-phenoxyacetamide
SMILESO=C(COc1ccccc1)NC1CCCOC1
InChIInChI=1S/C13H17NO3/c15-13(14-11-5-4-8-16-9-11)10-17-12-6-2-1-3-7-12/h1-3,6-7,11H,4-5,8-10H2,(H,14,15)
InChIKeyDSPDSKCGASPFLQ-UHFFFAOYSA-N
XLogP1.36
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.28
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-aminophenoxy)-N-(oxan-3-yl)acetamide
CID 55190193
N-(oxan-4-yl)-2-phenoxyacetamide
CID 61062946
N-(6-methyloxan-3-yl)-2-phenoxyacetamide
CID 155627872
N-(4-oxocyclohexyl)-2-phenoxyacetamide
CID 43652791
4-amino-N-(oxan-3-yl)-4-phenylbutanamide
CID 63363689
N-cyclooctyl-2-[(2-phenoxyacetyl)amino]acetamide
CID 24635122
2-(4-hydroxyphenoxy)-N-(oxan-4-yl)acetamide
CID 55182267
2-phenoxy-N-[1-(3-phenoxypropanoyl)piperidin-4-yl]acetamide
CID 108555833
N-[(1R,2R,3R)-2,3-dihydroxycyclohexyl]-2-phenoxyacetamide
CID 110164138
2-amino-N-(oxan-3-yl)-3-phenylpropanamide
CID 63361697
oxan-3-ylcarbamic acid
CID 68631624
[(3S)-oxan-3-yl]carbamic acid
CID 141364908

Frequently Asked Questions

What is the IUPAC name of N-(oxan-3-yl)-2-phenoxyacetamide?
The IUPAC name of N-(oxan-3-yl)-2-phenoxyacetamide (CID 142540024) is N-(oxan-3-yl)-2-phenoxyacetamide.
What is the SMILES notation for N-(oxan-3-yl)-2-phenoxyacetamide?
The canonical SMILES for N-(oxan-3-yl)-2-phenoxyacetamide is O=C(COc1ccccc1)NC1CCCOC1.
What is the InChIKey of N-(oxan-3-yl)-2-phenoxyacetamide?
The InChIKey is DSPDSKCGASPFLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO3/c15-13(14-11-5-4-8-16-9-11)10-17-12-6-2-1-3-7-12/h1-3,6-7,11H,4-5,8-10H2,(H,14,15).
What are the key properties of N-(oxan-3-yl)-2-phenoxyacetamide?
N-(oxan-3-yl)-2-phenoxyacetamide has a molecular weight of 235.28 g/mol, XLogP of 1.36, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxan-3-yl)-2-phenoxyacetamide is sourced from PubChem (CID 142540024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).