2-(4-cyanophenoxy)-N-(2-hydroxyphenyl)propanamide

C16H14N2O3 — CID 46665197

IUPAC2-(4-cyanophenoxy)-N-(2-hydroxyphenyl)propanamide
SMILESCC(Oc1ccc(C#N)cc1)C(=O)Nc1ccccc1O
InChIInChI=1S/C16H14N2O3/c1-11(21-13-8-6-12(10-17)7-9-13)16(20)18-14-4-2-3-5-15(14)19/h2-9,11,19H,1H3,(H,18,20)
InChIKeyBUINTSPIOVNQGN-UHFFFAOYSA-N
MW282.30 g/mol
LogP2.67
Rot. Bonds4

About 2-(4-cyanophenoxy)-N-(2-hydroxyphenyl)propanamide

2-(4-cyanophenoxy)-N-(2-hydroxyphenyl)propanamide (PubChem CID 46665197) has the molecular formula C16H14N2O3 and a molecular weight of 282.30 g/mol. Its IUPAC name is 2-(4-cyanophenoxy)-N-(2-hydroxyphenyl)propanamide.

Molecular Properties

Compound Name2-(4-cyanophenoxy)-N-(2-hydroxyphenyl)propanamide
PubChem CID46665197
Molecular FormulaC16H14N2O3
Molecular Weight282.30 g/mol
Exact Mass282.10
IUPAC Name2-(4-cyanophenoxy)-N-(2-hydroxyphenyl)propanamide
SMILESCC(Oc1ccc(C#N)cc1)C(=O)Nc1ccccc1O
InChIInChI=1S/C16H14N2O3/c1-11(21-13-8-6-12(10-17)7-9-13)16(20)18-14-4-2-3-5-15(14)19/h2-9,11,19H,1H3,(H,18,20)
InChIKeyBUINTSPIOVNQGN-UHFFFAOYSA-N
XLogP2.67
TPSA82.35 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol', 'substructure': 'N/A'}

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Related Compounds

(2R)-2-(4-cyanophenoxy)-N-(2-phenoxyphenyl)propanamide
CID 26524467
(2S)-2-(4-cyanophenoxy)-N-(2-phenoxyphenyl)propanamide
CID 26524469
(2R)-2-(4-cyanophenoxy)-N-phenylpropanamide
CID 7503300
(2R)-N-[2-[(2S)-butan-2-yl]phenyl]-2-(4-cyanophenoxy)propanamide
CID 7505965
[(2S)-1-(2-fluoroanilino)-1-oxopropan-2-yl] (2R)-2-(4-cyanophenoxy)propanoate
CID 7983734
(2S)-N-[2-[(2S)-butan-2-yl]phenyl]-2-[4-(4-cyanophenyl)phenoxy]propanamide
CID 7670740
(2S)-N-[2-[(2R)-butan-2-yl]phenyl]-2-[4-(4-cyanophenyl)phenoxy]propanamide
CID 7670734
2-(4-cyanophenoxy)-N-(3-hydroxy-2-pyridinyl)propanamide
CID 51188816
(2S)-2-(4-cyanophenoxy)-N-naphthalen-2-ylpropanamide
CID 9412867
2-(4-cyanophenoxy)-N-naphthalen-2-ylpropanamide
CID 78762344
(2R)-2-(4-cyanophenoxy)-N-(2,3,4-trifluorophenyl)propanamide
CID 7503342
2-(4-cyanophenoxy)-N-(2,6-difluorophenyl)propanamide
CID 51158907

Frequently Asked Questions

What is the IUPAC name of 2-(4-cyanophenoxy)-N-(2-hydroxyphenyl)propanamide?
The IUPAC name of 2-(4-cyanophenoxy)-N-(2-hydroxyphenyl)propanamide (CID 46665197) is 2-(4-cyanophenoxy)-N-(2-hydroxyphenyl)propanamide.
What is the SMILES notation for 2-(4-cyanophenoxy)-N-(2-hydroxyphenyl)propanamide?
The canonical SMILES for 2-(4-cyanophenoxy)-N-(2-hydroxyphenyl)propanamide is CC(Oc1ccc(C#N)cc1)C(=O)Nc1ccccc1O.
What is the InChIKey of 2-(4-cyanophenoxy)-N-(2-hydroxyphenyl)propanamide?
The InChIKey is BUINTSPIOVNQGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O3/c1-11(21-13-8-6-12(10-17)7-9-13)16(20)18-14-4-2-3-5-15(14)19/h2-9,11,19H,1H3,(H,18,20).
What are the key properties of 2-(4-cyanophenoxy)-N-(2-hydroxyphenyl)propanamide?
2-(4-cyanophenoxy)-N-(2-hydroxyphenyl)propanamide has a molecular weight of 282.30 g/mol, XLogP of 2.67, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyanophenoxy)-N-(2-hydroxyphenyl)propanamide is sourced from PubChem (CID 46665197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).