N-(3-hydroxy-6-methyl-2-pyridinyl)-3-nitrosobenzamide

C13H11N3O3 — CID 89096662

IUPACN-(3-hydroxy-6-methyl-2-pyridinyl)-3-nitrosobenzamide
SMILESCc1ccc(O)c(NC(=O)c2cccc(N=O)c2)n1
InChIInChI=1S/C13H11N3O3/c1-8-5-6-11(17)12(14-8)15-13(18)9-3-2-4-10(7-9)16-19/h2-7,17H,1H3,(H,14,15,18)
InChIKeySXNOTJMNBNPXDH-UHFFFAOYSA-N
MW257.25 g/mol
LogP2.75
Rot. Bonds3

About N-(3-hydroxy-6-methyl-2-pyridinyl)-3-nitrosobenzamide

N-(3-hydroxy-6-methyl-2-pyridinyl)-3-nitrosobenzamide (PubChem CID 89096662) has the molecular formula C13H11N3O3 and a molecular weight of 257.25 g/mol. Its IUPAC name is N-(3-hydroxy-6-methyl-2-pyridinyl)-3-nitrosobenzamide.

Molecular Properties

Compound NameN-(3-hydroxy-6-methyl-2-pyridinyl)-3-nitrosobenzamide
PubChem CID89096662
Molecular FormulaC13H11N3O3
Molecular Weight257.25 g/mol
Exact Mass257.08
IUPAC NameN-(3-hydroxy-6-methyl-2-pyridinyl)-3-nitrosobenzamide
SMILESCc1ccc(O)c(NC(=O)c2cccc(N=O)c2)n1
InChIInChI=1S/C13H11N3O3/c1-8-5-6-11(17)12(14-8)15-13(18)9-3-2-4-10(7-9)16-19/h2-7,17H,1H3,(H,14,15,18)
InChIKeySXNOTJMNBNPXDH-UHFFFAOYSA-N
XLogP2.75
TPSA91.65 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.25
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-3-nitrosobenzamide
CID 89195541
N-(3-hydroxy-6-methyl-2-pyridinyl)-3-methylimidazo[4,5-b]pyridine-6-carboxamide
CID 75509490
3-(methoxymethyl)-N-(3-methoxy-6-methyl-2-pyridinyl)benzamide
CID 71982976
3-(dimethylamino)-N-(3-hydroxy-2-pyridinyl)benzamide
CID 30160840
N-(3-hydroxy-2-pyridinyl)-6-methylpyridine-2-carboxamide
CID 47152291
3-methyl-N-(6-methyl-2-pyridinyl)benzamide
CID 966005
3-[(2-hydroxy-5-methylphenyl)carbamoyl]benzoic acid
CID 75465271
N-(3-hydroxy-2-pyridinyl)-4-methylbenzamide
CID 25342946
methyl 3-[(6-methyl-2-pyridinyl)carbamoyl]benzoate
CID 108799748
N-(4,6-dimethylpyrimidin-2-yl)-4-hydroxy-3-methylbenzamide
CID 107676575
1-(2-aminoethyl)-N-(3-hydroxy-6-methyl-2-pyridinyl)imidazole-4-carboxamide
CID 107499624
3-iodo-N-(2-methylquinolin-5-yl)benzamide
CID 17099145

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxy-6-methyl-2-pyridinyl)-3-nitrosobenzamide?
The IUPAC name of N-(3-hydroxy-6-methyl-2-pyridinyl)-3-nitrosobenzamide (CID 89096662) is N-(3-hydroxy-6-methyl-2-pyridinyl)-3-nitrosobenzamide.
What is the SMILES notation for N-(3-hydroxy-6-methyl-2-pyridinyl)-3-nitrosobenzamide?
The canonical SMILES for N-(3-hydroxy-6-methyl-2-pyridinyl)-3-nitrosobenzamide is Cc1ccc(O)c(NC(=O)c2cccc(N=O)c2)n1.
What is the InChIKey of N-(3-hydroxy-6-methyl-2-pyridinyl)-3-nitrosobenzamide?
The InChIKey is SXNOTJMNBNPXDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3O3/c1-8-5-6-11(17)12(14-8)15-13(18)9-3-2-4-10(7-9)16-19/h2-7,17H,1H3,(H,14,15,18).
What are the key properties of N-(3-hydroxy-6-methyl-2-pyridinyl)-3-nitrosobenzamide?
N-(3-hydroxy-6-methyl-2-pyridinyl)-3-nitrosobenzamide has a molecular weight of 257.25 g/mol, XLogP of 2.75, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxy-6-methyl-2-pyridinyl)-3-nitrosobenzamide is sourced from PubChem (CID 89096662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).