N-(2-chloro-4,6-dimethyl-3-pyridinyl)-2-hydroxybenzamide

C14H13ClN2O2 — CID 15168931

IUPACN-(2-chloro-4,6-dimethyl-3-pyridinyl)-2-hydroxybenzamide
SMILESCc1cc(C)c(NC(=O)c2ccccc2O)c(Cl)n1
InChIInChI=1S/C14H13ClN2O2/c1-8-7-9(2)16-13(15)12(8)17-14(19)10-5-3-4-6-11(10)18/h3-7,18H,1-2H3,(H,17,19)
InChIKeyNNMLDVZZZAEGDZ-UHFFFAOYSA-N
MW276.72 g/mol
LogP3.31
Rot. Bonds2

About N-(2-chloro-4,6-dimethyl-3-pyridinyl)-2-hydroxybenzamide

N-(2-chloro-4,6-dimethyl-3-pyridinyl)-2-hydroxybenzamide (PubChem CID 15168931) has the molecular formula C14H13ClN2O2 and a molecular weight of 276.72 g/mol. Its IUPAC name is N-(2-chloro-4,6-dimethyl-3-pyridinyl)-2-hydroxybenzamide.

Molecular Properties

Compound NameN-(2-chloro-4,6-dimethyl-3-pyridinyl)-2-hydroxybenzamide
PubChem CID15168931
Molecular FormulaC14H13ClN2O2
Molecular Weight276.72 g/mol
Exact Mass276.07
IUPAC NameN-(2-chloro-4,6-dimethyl-3-pyridinyl)-2-hydroxybenzamide
SMILESCc1cc(C)c(NC(=O)c2ccccc2O)c(Cl)n1
InChIInChI=1S/C14H13ClN2O2/c1-8-7-9(2)16-13(15)12(8)17-14(19)10-5-3-4-6-11(10)18/h3-7,18H,1-2H3,(H,17,19)
InChIKeyNNMLDVZZZAEGDZ-UHFFFAOYSA-N
XLogP3.31
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.72
LogP ≤ 53.31
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

2-chloro-N-(2-hydroxyphenyl)-4,6-dimethylpyridine-3-carboxamide
CID 4862041
N-(4,6-dimethyl-2-pyridinyl)-2-hydroxybenzamide
CID 13440640
2-chloro-N-(4-hydroxy-2,6-dimethylphenyl)benzamide
CID 706333
5-bromo-2-chloro-N-(2,6-dichloro-4-methyl-3-pyridinyl)benzamide
CID 103738286
N-(3-amino-2,6-dimethylphenyl)-2-hydroxybenzamide
CID 24708392
N-(2,6-dichloropyrimidin-4-yl)-2-hydroxybenzamide
CID 114073527
N-(2-chloro-5-methylphenyl)-2-hydroxybenzamide
CID 103769569
N-(2,6-dichloro-4-methyl-3-pyridinyl)-2,5-difluorobenzamide
CID 103738259
N-(2-chloro-4-methyl-3-pyridinyl)-2-iodobenzamide
CID 65488908
1-butyl-3-(2-chloro-4,6-dimethyl-3-pyridinyl)urea
CID 593495
N-(4-hydroxy-2,6-dimethylphenyl)-2-iodobenzamide
CID 5120738
1-(2-chloro-4,6-dimethyl-3-pyridinyl)-3-(4-hydroxy-2-methylbutan-2-yl)urea
CID 111926719

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-4,6-dimethyl-3-pyridinyl)-2-hydroxybenzamide?
The IUPAC name of N-(2-chloro-4,6-dimethyl-3-pyridinyl)-2-hydroxybenzamide (CID 15168931) is N-(2-chloro-4,6-dimethyl-3-pyridinyl)-2-hydroxybenzamide.
What is the SMILES notation for N-(2-chloro-4,6-dimethyl-3-pyridinyl)-2-hydroxybenzamide?
The canonical SMILES for N-(2-chloro-4,6-dimethyl-3-pyridinyl)-2-hydroxybenzamide is Cc1cc(C)c(NC(=O)c2ccccc2O)c(Cl)n1.
What is the InChIKey of N-(2-chloro-4,6-dimethyl-3-pyridinyl)-2-hydroxybenzamide?
The InChIKey is NNMLDVZZZAEGDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClN2O2/c1-8-7-9(2)16-13(15)12(8)17-14(19)10-5-3-4-6-11(10)18/h3-7,18H,1-2H3,(H,17,19).
What are the key properties of N-(2-chloro-4,6-dimethyl-3-pyridinyl)-2-hydroxybenzamide?
N-(2-chloro-4,6-dimethyl-3-pyridinyl)-2-hydroxybenzamide has a molecular weight of 276.72 g/mol, XLogP of 3.31, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-4,6-dimethyl-3-pyridinyl)-2-hydroxybenzamide is sourced from PubChem (CID 15168931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).