N-(4-cyanophenyl)-2-hydroxyprop-2-enamide

C10H8N2O2 — CID 141009909

IUPACN-(4-cyanophenyl)-2-hydroxyprop-2-enamide
SMILESC=C(O)C(=O)Nc1ccc(C#N)cc1
InChIInChI=1S/C10H8N2O2/c1-7(13)10(14)12-9-4-2-8(6-11)3-5-9/h2-5,13H,1H2,(H,12,14)
InChIKeyINYRGSMVNUXCCY-UHFFFAOYSA-N
MW188.19 g/mol
LogP1.57
Rot. Bonds2

About N-(4-cyanophenyl)-2-hydroxyprop-2-enamide

N-(4-cyanophenyl)-2-hydroxyprop-2-enamide (PubChem CID 141009909) has the molecular formula C10H8N2O2 and a molecular weight of 188.19 g/mol. Its IUPAC name is N-(4-cyanophenyl)-2-hydroxyprop-2-enamide.

Molecular Properties

Compound NameN-(4-cyanophenyl)-2-hydroxyprop-2-enamide
PubChem CID141009909
Molecular FormulaC10H8N2O2
Molecular Weight188.19 g/mol
Exact Mass188.06
IUPAC NameN-(4-cyanophenyl)-2-hydroxyprop-2-enamide
SMILESC=C(O)C(=O)Nc1ccc(C#N)cc1
InChIInChI=1S/C10H8N2O2/c1-7(13)10(14)12-9-4-2-8(6-11)3-5-9/h2-5,13H,1H2,(H,12,14)
InChIKeyINYRGSMVNUXCCY-UHFFFAOYSA-N
XLogP1.57
TPSA73.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.19
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

N-(4-cyanophenyl)-2-methylprop-2-enamide;molecular hydrogen
CID 142912025
2-cyano-N-(4-cyanophenyl)-3-hydroxy-4-methylpenta-2,4-dienamide
CID 152757521
N,N'-bis(4-cyanophenyl)propanediamide
CID 108956949
N'-tert-butyl-N-(4-cyanophenyl)oxamide
CID 108506832
N-(4-cyanophenyl)prop-2-ynamide
CID 131045774
N-(4-cyanophenyl)-N'-(4-methylthiophen-3-yl)oxamide
CID 91650907
(Z)-2-cyano-3-(4-cyanoanilino)-N-(4-hydroxyphenyl)prop-2-enamide
CID 108827373
N'-(2-cyanophenyl)-N-(4-cyanophenyl)oxamide
CID 108501554
N'-[(E)-benzylideneamino]-N-(4-cyanophenyl)oxamide
CID 19661465
N,N'-bis(4-cyanophenyl)pentanediamide
CID 730657
N-(4-cyanophenyl)-2,2-dimethylpropanamide
CID 4927441
(4-cyanophenyl) 2-anilino-2-oxoacetate
CID 58981566

Frequently Asked Questions

What is the IUPAC name of N-(4-cyanophenyl)-2-hydroxyprop-2-enamide?
The IUPAC name of N-(4-cyanophenyl)-2-hydroxyprop-2-enamide (CID 141009909) is N-(4-cyanophenyl)-2-hydroxyprop-2-enamide.
What is the SMILES notation for N-(4-cyanophenyl)-2-hydroxyprop-2-enamide?
The canonical SMILES for N-(4-cyanophenyl)-2-hydroxyprop-2-enamide is C=C(O)C(=O)Nc1ccc(C#N)cc1.
What is the InChIKey of N-(4-cyanophenyl)-2-hydroxyprop-2-enamide?
The InChIKey is INYRGSMVNUXCCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N2O2/c1-7(13)10(14)12-9-4-2-8(6-11)3-5-9/h2-5,13H,1H2,(H,12,14).
What are the key properties of N-(4-cyanophenyl)-2-hydroxyprop-2-enamide?
N-(4-cyanophenyl)-2-hydroxyprop-2-enamide has a molecular weight of 188.19 g/mol, XLogP of 1.57, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyanophenyl)-2-hydroxyprop-2-enamide is sourced from PubChem (CID 141009909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).