2-(oxan-4-yl)-N-phenylacetamide

C13H17NO2 — CID 110856528

IUPAC2-(oxan-4-yl)-N-phenylacetamide
SMILESO=C(CC1CCOCC1)Nc1ccccc1
InChIInChI=1S/C13H17NO2/c15-13(10-11-6-8-16-9-7-11)14-12-4-2-1-3-5-12/h1-5,11H,6-10H2,(H,14,15)
InChIKeyQJXUREGQTDQSGL-UHFFFAOYSA-N
MW219.28 g/mol
LogP2.44
Rot. Bonds3

About 2-(oxan-4-yl)-N-phenylacetamide

2-(oxan-4-yl)-N-phenylacetamide (PubChem CID 110856528) has the molecular formula C13H17NO2 and a molecular weight of 219.28 g/mol. Its IUPAC name is 2-(oxan-4-yl)-N-phenylacetamide.

Molecular Properties

Compound Name2-(oxan-4-yl)-N-phenylacetamide
PubChem CID110856528
Molecular FormulaC13H17NO2
Molecular Weight219.28 g/mol
Exact Mass219.13
IUPAC Name2-(oxan-4-yl)-N-phenylacetamide
SMILESO=C(CC1CCOCC1)Nc1ccccc1
InChIInChI=1S/C13H17NO2/c15-13(10-11-6-8-16-9-7-11)14-12-4-2-1-3-5-12/h1-5,11H,6-10H2,(H,14,15)
InChIKeyQJXUREGQTDQSGL-UHFFFAOYSA-N
XLogP2.44
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.28
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclopropyl-N-phenylacetamide
CID 60753326
2-(oxan-4-yl)-N-[4-[[(1R)-1-phenylethyl]amino]phenyl]acetamide
CID 124565645
2-[3-[[2-(oxan-4-yl)acetyl]amino]phenyl]acetic acid
CID 119351700
N-(3-acetylphenyl)-2-(oxan-4-yl)acetamide
CID 110861044
2-(oxan-4-yl)-N-(4-pyrrolidin-1-ylphenyl)acetamide
CID 110862088
5-[[2-(oxan-4-yl)acetyl]amino]pyridine-2-carboxylic acid
CID 115273633
N-(4-fluorophenyl)-2-[(3R)-oxolan-3-yl]acetamide
CID 126789596
N-(3,5-dichloro-4-hydroxyphenyl)-2-(oxan-4-yl)acetamide
CID 75437896
N-(2-cyanophenyl)-2-(oxan-4-yl)acetamide
CID 110864676
N-(3,5-dimethoxyphenyl)-2-(oxan-4-yl)acetamide
CID 91918174
N-[2-(ethylaminomethyl)phenyl]-2-(oxan-4-yl)acetamide
CID 119440769
N-phenyl-2-(1-pyridin-4-ylpiperidin-4-yl)acetamide
CID 140968172

Frequently Asked Questions

What is the IUPAC name of 2-(oxan-4-yl)-N-phenylacetamide?
The IUPAC name of 2-(oxan-4-yl)-N-phenylacetamide (CID 110856528) is 2-(oxan-4-yl)-N-phenylacetamide.
What is the SMILES notation for 2-(oxan-4-yl)-N-phenylacetamide?
The canonical SMILES for 2-(oxan-4-yl)-N-phenylacetamide is O=C(CC1CCOCC1)Nc1ccccc1.
What is the InChIKey of 2-(oxan-4-yl)-N-phenylacetamide?
The InChIKey is QJXUREGQTDQSGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO2/c15-13(10-11-6-8-16-9-7-11)14-12-4-2-1-3-5-12/h1-5,11H,6-10H2,(H,14,15).
What are the key properties of 2-(oxan-4-yl)-N-phenylacetamide?
2-(oxan-4-yl)-N-phenylacetamide has a molecular weight of 219.28 g/mol, XLogP of 2.44, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(oxan-4-yl)-N-phenylacetamide is sourced from PubChem (CID 110856528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).