2-(4-cyanophenoxy)-N-[2-(oxolan-2-yl)ethyl]acetamide

C15H18N2O3 — CID 51076291

IUPAC2-(4-cyanophenoxy)-N-[2-(oxolan-2-yl)ethyl]acetamide
SMILESN#Cc1ccc(OCC(=O)NCCC2CCCO2)cc1
InChIInChI=1S/C15H18N2O3/c16-10-12-3-5-14(6-4-12)20-11-15(18)17-8-7-13-2-1-9-19-13/h3-6,13H,1-2,7-9,11H2,(H,17,18)
InChIKeyKQOSAKZNECZEQN-UHFFFAOYSA-N
MW274.32 g/mol
LogP1.62
Rot. Bonds6

About 2-(4-cyanophenoxy)-N-[2-(oxolan-2-yl)ethyl]acetamide

2-(4-cyanophenoxy)-N-[2-(oxolan-2-yl)ethyl]acetamide (PubChem CID 51076291) has the molecular formula C15H18N2O3 and a molecular weight of 274.32 g/mol. Its IUPAC name is 2-(4-cyanophenoxy)-N-[2-(oxolan-2-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-(4-cyanophenoxy)-N-[2-(oxolan-2-yl)ethyl]acetamide
PubChem CID51076291
Molecular FormulaC15H18N2O3
Molecular Weight274.32 g/mol
Exact Mass274.13
IUPAC Name2-(4-cyanophenoxy)-N-[2-(oxolan-2-yl)ethyl]acetamide
SMILESN#Cc1ccc(OCC(=O)NCCC2CCCO2)cc1
InChIInChI=1S/C15H18N2O3/c16-10-12-3-5-14(6-4-12)20-11-15(18)17-8-7-13-2-1-9-19-13/h3-6,13H,1-2,7-9,11H2,(H,17,18)
InChIKeyKQOSAKZNECZEQN-UHFFFAOYSA-N
XLogP1.62
TPSA71.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-fluorophenoxy)-N-[2-(oxolan-2-yl)ethyl]acetamide
CID 110731293
2-(4-acetylphenoxy)-N-[2-(oxan-2-yl)ethyl]acetamide
CID 77089115
2-(4-cyanophenoxy)-N-(oxan-3-ylmethyl)acetamide
CID 47314511
2-(4-cyanophenoxy)ethyl 4-(oxolan-2-ylmethoxy)benzoate
CID 46793890
N-[2-(oxolan-2-yl)ethyl]-3-phenoxypropanamide
CID 75871156
2-(4-cyanophenoxy)-N-ethyl-N-(oxolan-2-ylmethyl)acetamide
CID 61344785
2-(3-chloro-4-cyanophenoxy)-N-[[(2R)-oxolan-2-yl]methyl]acetamide
CID 99830322
[2-oxo-2-[[(2S)-oxolan-2-yl]methylamino]ethyl] (2S)-2-(4-cyanophenoxy)propanoate
CID 7984182
2-(4-cyano-2-methoxyphenoxy)-N-[[(2S)-oxolan-2-yl]methyl]acetamide
CID 2492539
N-[[4-(oxolan-2-ylmethoxy)phenyl]methyl]-2-phenoxyacetamide
CID 42961546
4-cyano-N-[[(2R)-oxolan-2-yl]methyl]-N-[[(2S)-oxolan-2-yl]methyl]benzamide
CID 94817152
2-[4-[2-[3-(oxan-2-yl)propanoylamino]ethyl]phenoxy]acetic acid
CID 119255944

Frequently Asked Questions

What is the IUPAC name of 2-(4-cyanophenoxy)-N-[2-(oxolan-2-yl)ethyl]acetamide?
The IUPAC name of 2-(4-cyanophenoxy)-N-[2-(oxolan-2-yl)ethyl]acetamide (CID 51076291) is 2-(4-cyanophenoxy)-N-[2-(oxolan-2-yl)ethyl]acetamide.
What is the SMILES notation for 2-(4-cyanophenoxy)-N-[2-(oxolan-2-yl)ethyl]acetamide?
The canonical SMILES for 2-(4-cyanophenoxy)-N-[2-(oxolan-2-yl)ethyl]acetamide is N#Cc1ccc(OCC(=O)NCCC2CCCO2)cc1.
What is the InChIKey of 2-(4-cyanophenoxy)-N-[2-(oxolan-2-yl)ethyl]acetamide?
The InChIKey is KQOSAKZNECZEQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3/c16-10-12-3-5-14(6-4-12)20-11-15(18)17-8-7-13-2-1-9-19-13/h3-6,13H,1-2,7-9,11H2,(H,17,18).
What are the key properties of 2-(4-cyanophenoxy)-N-[2-(oxolan-2-yl)ethyl]acetamide?
2-(4-cyanophenoxy)-N-[2-(oxolan-2-yl)ethyl]acetamide has a molecular weight of 274.32 g/mol, XLogP of 1.62, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyanophenoxy)-N-[2-(oxolan-2-yl)ethyl]acetamide is sourced from PubChem (CID 51076291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).