2-(3-ethylphenoxy)-N-[(4-hydroxyoxan-4-yl)methyl]acetamide

C16H23NO4 — CID 79037319

IUPAC2-(3-ethylphenoxy)-N-[(4-hydroxyoxan-4-yl)methyl]acetamide
SMILESCCc1cccc(OCC(=O)NCC2(O)CCOCC2)c1
InChIInChI=1S/C16H23NO4/c1-2-13-4-3-5-14(10-13)21-11-15(18)17-12-16(19)6-8-20-9-7-16/h3-5,10,19H,2,6-9,11-12H2,1H3,(H,17,18)
InChIKeyOKVYSQXMXGCVKR-UHFFFAOYSA-N
MW293.36 g/mol
LogP1.29
Rot. Bonds6

About 2-(3-ethylphenoxy)-N-[(4-hydroxyoxan-4-yl)methyl]acetamide

2-(3-ethylphenoxy)-N-[(4-hydroxyoxan-4-yl)methyl]acetamide (PubChem CID 79037319) has the molecular formula C16H23NO4 and a molecular weight of 293.36 g/mol. Its IUPAC name is 2-(3-ethylphenoxy)-N-[(4-hydroxyoxan-4-yl)methyl]acetamide.

Molecular Properties

Compound Name2-(3-ethylphenoxy)-N-[(4-hydroxyoxan-4-yl)methyl]acetamide
PubChem CID79037319
Molecular FormulaC16H23NO4
Molecular Weight293.36 g/mol
Exact Mass293.16
IUPAC Name2-(3-ethylphenoxy)-N-[(4-hydroxyoxan-4-yl)methyl]acetamide
SMILESCCc1cccc(OCC(=O)NCC2(O)CCOCC2)c1
InChIInChI=1S/C16H23NO4/c1-2-13-4-3-5-14(10-13)21-11-15(18)17-12-16(19)6-8-20-9-7-16/h3-5,10,19H,2,6-9,11-12H2,1H3,(H,17,18)
InChIKeyOKVYSQXMXGCVKR-UHFFFAOYSA-N
XLogP1.29
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.36
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(3-ethylphenoxy)-N-[(4-hydroxyoxan-4-yl)methyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(3-ethylphenoxy)-N-[(1-hydroxycyclobutyl)methyl]acetamide
CID 115643579
2-(3-ethylphenoxy)-N-[(1-hydroxycyclohexyl)methyl]acetamide
CID 64866142
N-[(4-hydroxyoxan-4-yl)methyl]-2-naphthalen-2-yloxyacetamide
CID 56765194
N-[[(3S)-3-hydroxyoxolan-3-yl]methyl]-2-naphthalen-2-yloxyacetamide
CID 129397645
2-(3-aminophenoxy)-N-[(1-hydroxycyclopentyl)methyl]acetamide
CID 65103467
N-[(4-hydroxyoxan-4-yl)methyl]-2-phenylacetamide
CID 79038917
2-(3-ethylphenoxy)-N'-methylacetohydrazide
CID 116820670
2-(3-ethylphenoxy)-N-prop-2-enylacetamide
CID 19177242
4-[[[2-(3-acetylphenoxy)acetyl]amino]methyl]oxane-4-carboxylic acid
CID 120541544
2-(3-chlorophenyl)-N-[(4-hydroxyoxan-4-yl)methyl]acetamide
CID 79039515
methyl 3-[[2-(3-ethylphenoxy)acetyl]amino]propanoate
CID 60637022
N'-acetyl-2-(3-ethylphenoxy)acetohydrazide
CID 43011736

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethylphenoxy)-N-[(4-hydroxyoxan-4-yl)methyl]acetamide?
The IUPAC name of 2-(3-ethylphenoxy)-N-[(4-hydroxyoxan-4-yl)methyl]acetamide (CID 79037319) is 2-(3-ethylphenoxy)-N-[(4-hydroxyoxan-4-yl)methyl]acetamide.
What is the SMILES notation for 2-(3-ethylphenoxy)-N-[(4-hydroxyoxan-4-yl)methyl]acetamide?
The canonical SMILES for 2-(3-ethylphenoxy)-N-[(4-hydroxyoxan-4-yl)methyl]acetamide is CCc1cccc(OCC(=O)NCC2(O)CCOCC2)c1.
What is the InChIKey of 2-(3-ethylphenoxy)-N-[(4-hydroxyoxan-4-yl)methyl]acetamide?
The InChIKey is OKVYSQXMXGCVKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO4/c1-2-13-4-3-5-14(10-13)21-11-15(18)17-12-16(19)6-8-20-9-7-16/h3-5,10,19H,2,6-9,11-12H2,1H3,(H,17,18).
What are the key properties of 2-(3-ethylphenoxy)-N-[(4-hydroxyoxan-4-yl)methyl]acetamide?
2-(3-ethylphenoxy)-N-[(4-hydroxyoxan-4-yl)methyl]acetamide has a molecular weight of 293.36 g/mol, XLogP of 1.29, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethylphenoxy)-N-[(4-hydroxyoxan-4-yl)methyl]acetamide is sourced from PubChem (CID 79037319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).