N-(2-chloro-4-pyridinyl)-2-hydroxy-5-methylbenzamide

C13H11ClN2O2 — CID 114053486

IUPACN-(2-chloro-4-pyridinyl)-2-hydroxy-5-methylbenzamide
SMILESCc1ccc(O)c(C(=O)Nc2ccnc(Cl)c2)c1
InChIInChI=1S/C13H11ClN2O2/c1-8-2-3-11(17)10(6-8)13(18)16-9-4-5-15-12(14)7-9/h2-7,17H,1H3,(H,15,16,18)
InChIKeyPKQWOYAEFGNLAW-UHFFFAOYSA-N
MW262.70 g/mol
LogP3.00
Rot. Bonds2

About N-(2-chloro-4-pyridinyl)-2-hydroxy-5-methylbenzamide

N-(2-chloro-4-pyridinyl)-2-hydroxy-5-methylbenzamide (PubChem CID 114053486) has the molecular formula C13H11ClN2O2 and a molecular weight of 262.70 g/mol. Its IUPAC name is N-(2-chloro-4-pyridinyl)-2-hydroxy-5-methylbenzamide.

Molecular Properties

Compound NameN-(2-chloro-4-pyridinyl)-2-hydroxy-5-methylbenzamide
PubChem CID114053486
Molecular FormulaC13H11ClN2O2
Molecular Weight262.70 g/mol
Exact Mass262.05
IUPAC NameN-(2-chloro-4-pyridinyl)-2-hydroxy-5-methylbenzamide
SMILESCc1ccc(O)c(C(=O)Nc2ccnc(Cl)c2)c1
InChIInChI=1S/C13H11ClN2O2/c1-8-2-3-11(17)10(6-8)13(18)16-9-4-5-15-12(14)7-9/h2-7,17H,1H3,(H,15,16,18)
InChIKeyPKQWOYAEFGNLAW-UHFFFAOYSA-N
XLogP3.00
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.70
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-amino-N-(2-chloro-4-pyridinyl)-2,4-dimethylbenzamide
CID 102705824
N-(5-chloro-2-pyridinyl)-2-hydroxy-5-methylbenzamide
CID 28831587
5-chloro-2-hydroxy-N-(2-methylpyrimidin-5-yl)benzamide
CID 167975567
2-[(2-chloro-4-pyridinyl)carbamoyl]-3,6-dimethylbenzoic acid
CID 103429218
N-(4-chloro-1,3-thiazol-2-yl)-2-hydroxy-5-methylbenzamide
CID 102523467
N-(2-chloro-4-pyridinyl)pyrimidine-4-carboxamide
CID 140508287
5-amino-2,3-dichloro-N-(2-chloro-4-pyridinyl)benzamide
CID 107185676
N-[3-(dimethylamino)-4-methylphenyl]-2-hydroxy-5-methylbenzamide
CID 115377986
2-fluoro-4-[(2-hydroxy-5-methylbenzoyl)amino]benzoic acid
CID 103867339
2-bromo-5-[(2-hydroxy-5-methylbenzoyl)amino]benzoic acid
CID 115295861
5-chloro-2-hydroxy-N-[2-(trifluoromethyl)-4-pyridinyl]benzamide
CID 168876082
N,N'-bis(2-chloro-4-pyridinyl)propanediamide
CID 86045636

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-4-pyridinyl)-2-hydroxy-5-methylbenzamide?
The IUPAC name of N-(2-chloro-4-pyridinyl)-2-hydroxy-5-methylbenzamide (CID 114053486) is N-(2-chloro-4-pyridinyl)-2-hydroxy-5-methylbenzamide.
What is the SMILES notation for N-(2-chloro-4-pyridinyl)-2-hydroxy-5-methylbenzamide?
The canonical SMILES for N-(2-chloro-4-pyridinyl)-2-hydroxy-5-methylbenzamide is Cc1ccc(O)c(C(=O)Nc2ccnc(Cl)c2)c1.
What is the InChIKey of N-(2-chloro-4-pyridinyl)-2-hydroxy-5-methylbenzamide?
The InChIKey is PKQWOYAEFGNLAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11ClN2O2/c1-8-2-3-11(17)10(6-8)13(18)16-9-4-5-15-12(14)7-9/h2-7,17H,1H3,(H,15,16,18).
What are the key properties of N-(2-chloro-4-pyridinyl)-2-hydroxy-5-methylbenzamide?
N-(2-chloro-4-pyridinyl)-2-hydroxy-5-methylbenzamide has a molecular weight of 262.70 g/mol, XLogP of 3.00, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-4-pyridinyl)-2-hydroxy-5-methylbenzamide is sourced from PubChem (CID 114053486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).