N-(3-cyano-5-hydroxyphenyl)-4-hydroxybenzamide

C14H10N2O3 — CID 162516370

IUPACN-(3-cyano-5-hydroxyphenyl)-4-hydroxybenzamide
SMILESN#Cc1cc(O)cc(NC(=O)c2ccc(O)cc2)c1
InChIInChI=1S/C14H10N2O3/c15-8-9-5-11(7-13(18)6-9)16-14(19)10-1-3-12(17)4-2-10/h1-7,17-18H,(H,16,19)
InChIKeyPSDWCAVMVBBFRK-UHFFFAOYSA-N
MW254.25 g/mol
LogP2.22
Rot. Bonds2

About N-(3-cyano-5-hydroxyphenyl)-4-hydroxybenzamide

N-(3-cyano-5-hydroxyphenyl)-4-hydroxybenzamide (PubChem CID 162516370) has the molecular formula C14H10N2O3 and a molecular weight of 254.25 g/mol. Its IUPAC name is N-(3-cyano-5-hydroxyphenyl)-4-hydroxybenzamide.

Molecular Properties

Compound NameN-(3-cyano-5-hydroxyphenyl)-4-hydroxybenzamide
PubChem CID162516370
Molecular FormulaC14H10N2O3
Molecular Weight254.25 g/mol
Exact Mass254.07
IUPAC NameN-(3-cyano-5-hydroxyphenyl)-4-hydroxybenzamide
SMILESN#Cc1cc(O)cc(NC(=O)c2ccc(O)cc2)c1
InChIInChI=1S/C14H10N2O3/c15-8-9-5-11(7-13(18)6-9)16-14(19)10-1-3-12(17)4-2-10/h1-7,17-18H,(H,16,19)
InChIKeyPSDWCAVMVBBFRK-UHFFFAOYSA-N
XLogP2.22
TPSA93.35 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.25
LogP ≤ 52.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-cyanophenyl)-4-[4-[(3-cyanophenyl)carbamoyl]phenyl]benzamide
CID 90213286
N-(3-cyanophenyl)-4-iodobenzamide
CID 875242
N-(3-cyanophenyl)-4-(methylamino)benzamide
CID 62166375
1-N-(3-chlorophenyl)-4-N-(3-cyanophenyl)benzene-1,4-dicarboxamide
CID 109049974
4-cyano-N-(3-hydroxy-4-methylphenyl)benzamide
CID 64792528
4-N-(4-chlorophenyl)-1-N-(4-cyanophenyl)benzene-1,4-dicarboxamide
CID 109049994
N-(4-cyanophenyl)-4-hydrazinylbenzamide
CID 55052706
4-N-(3-cyanophenyl)-1-N-(4-fluorophenyl)benzene-1,4-dicarboxamide
CID 109049931
N-(3-cyanophenyl)pyridine-4-carboxamide
CID 734714
N-(3-cyanophenyl)-4-propan-2-ylbenzamide
CID 2552298
N-(3-cyanophenyl)-4-ethylbenzamide
CID 2552285
N-(3-cyanophenyl)-4-(iodomethyl)benzamide
CID 91264729

Frequently Asked Questions

What is the IUPAC name of N-(3-cyano-5-hydroxyphenyl)-4-hydroxybenzamide?
The IUPAC name of N-(3-cyano-5-hydroxyphenyl)-4-hydroxybenzamide (CID 162516370) is N-(3-cyano-5-hydroxyphenyl)-4-hydroxybenzamide.
What is the SMILES notation for N-(3-cyano-5-hydroxyphenyl)-4-hydroxybenzamide?
The canonical SMILES for N-(3-cyano-5-hydroxyphenyl)-4-hydroxybenzamide is N#Cc1cc(O)cc(NC(=O)c2ccc(O)cc2)c1.
What is the InChIKey of N-(3-cyano-5-hydroxyphenyl)-4-hydroxybenzamide?
The InChIKey is PSDWCAVMVBBFRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N2O3/c15-8-9-5-11(7-13(18)6-9)16-14(19)10-1-3-12(17)4-2-10/h1-7,17-18H,(H,16,19).
What are the key properties of N-(3-cyano-5-hydroxyphenyl)-4-hydroxybenzamide?
N-(3-cyano-5-hydroxyphenyl)-4-hydroxybenzamide has a molecular weight of 254.25 g/mol, XLogP of 2.22, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyano-5-hydroxyphenyl)-4-hydroxybenzamide is sourced from PubChem (CID 162516370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).