N-(6-chloro-4-methyl-3-pyridinyl)-2,4-dihydroxybenzamide

C13H11ClN2O3 — CID 113266619

IUPACN-(6-chloro-4-methyl-3-pyridinyl)-2,4-dihydroxybenzamide
SMILESCc1cc(Cl)ncc1NC(=O)c1ccc(O)cc1O
InChIInChI=1S/C13H11ClN2O3/c1-7-4-12(14)15-6-10(7)16-13(19)9-3-2-8(17)5-11(9)18/h2-6,17-18H,1H3,(H,16,19)
InChIKeySVMPIMNMHZXEQJ-UHFFFAOYSA-N
MW278.70 g/mol
LogP2.71
Rot. Bonds2

About N-(6-chloro-4-methyl-3-pyridinyl)-2,4-dihydroxybenzamide

N-(6-chloro-4-methyl-3-pyridinyl)-2,4-dihydroxybenzamide (PubChem CID 113266619) has the molecular formula C13H11ClN2O3 and a molecular weight of 278.70 g/mol. Its IUPAC name is N-(6-chloro-4-methyl-3-pyridinyl)-2,4-dihydroxybenzamide.

Molecular Properties

Compound NameN-(6-chloro-4-methyl-3-pyridinyl)-2,4-dihydroxybenzamide
PubChem CID113266619
Molecular FormulaC13H11ClN2O3
Molecular Weight278.70 g/mol
Exact Mass278.05
IUPAC NameN-(6-chloro-4-methyl-3-pyridinyl)-2,4-dihydroxybenzamide
SMILESCc1cc(Cl)ncc1NC(=O)c1ccc(O)cc1O
InChIInChI=1S/C13H11ClN2O3/c1-7-4-12(14)15-6-10(7)16-13(19)9-3-2-8(17)5-11(9)18/h2-6,17-18H,1H3,(H,16,19)
InChIKeySVMPIMNMHZXEQJ-UHFFFAOYSA-N
XLogP2.71
TPSA82.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.70
LogP ≤ 52.71
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2,4-dihydroxy-N-[2-methyl-4-(methylamino)phenyl]benzamide
CID 143020352
6-bromo-N-(6-chloro-4-methyl-3-pyridinyl)pyridine-3-carboxamide
CID 113263005
N-(6-chloro-4-methyl-3-pyridinyl)-2-(3-hydroxyphenyl)acetamide
CID 113263695
4-fluoro-2-hydroxy-N-(4-hydroxy-2-methylphenyl)benzamide
CID 103889353
N-(6-chloro-4-methyl-3-pyridinyl)-4-ethylbenzamide
CID 113262953
N-(5-amino-3-methyl-2-pyridinyl)-2,4-dihydroxybenzamide
CID 107721514
2-chloro-5-fluoro-N-(4-hydroxy-2-methylphenyl)pyridine-3-carboxamide
CID 114034241
2,4-dichloro-N-(4-hydroxy-2-methylphenyl)benzamide
CID 849254
2,4-dihydroxy-N-(3-iodo-2-methylphenyl)benzamide
CID 113368797
N-(6-chloro-4-methyl-3-pyridinyl)-1,3,5-trimethylpyrazole-4-carboxamide
CID 113263016
2,5-dichloro-N-(4-fluoro-2-methylphenyl)pyridine-4-carboxamide
CID 114917077
2-[(4-chloro-2-hydroxybenzoyl)amino]-5-hydroxybenzoic acid
CID 61405727

Frequently Asked Questions

What is the IUPAC name of N-(6-chloro-4-methyl-3-pyridinyl)-2,4-dihydroxybenzamide?
The IUPAC name of N-(6-chloro-4-methyl-3-pyridinyl)-2,4-dihydroxybenzamide (CID 113266619) is N-(6-chloro-4-methyl-3-pyridinyl)-2,4-dihydroxybenzamide.
What is the SMILES notation for N-(6-chloro-4-methyl-3-pyridinyl)-2,4-dihydroxybenzamide?
The canonical SMILES for N-(6-chloro-4-methyl-3-pyridinyl)-2,4-dihydroxybenzamide is Cc1cc(Cl)ncc1NC(=O)c1ccc(O)cc1O.
What is the InChIKey of N-(6-chloro-4-methyl-3-pyridinyl)-2,4-dihydroxybenzamide?
The InChIKey is SVMPIMNMHZXEQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11ClN2O3/c1-7-4-12(14)15-6-10(7)16-13(19)9-3-2-8(17)5-11(9)18/h2-6,17-18H,1H3,(H,16,19).
What are the key properties of N-(6-chloro-4-methyl-3-pyridinyl)-2,4-dihydroxybenzamide?
N-(6-chloro-4-methyl-3-pyridinyl)-2,4-dihydroxybenzamide has a molecular weight of 278.70 g/mol, XLogP of 2.71, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-chloro-4-methyl-3-pyridinyl)-2,4-dihydroxybenzamide is sourced from PubChem (CID 113266619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).