6-(3-bromophenoxy)-N-(2-hydroxy-5-methylphenyl)pyridine-3-carboxamide

C19H15BrN2O3 — CID 60562203

IUPAC6-(3-bromophenoxy)-N-(2-hydroxy-5-methylphenyl)pyridine-3-carboxamide
SMILESCc1ccc(O)c(NC(=O)c2ccc(Oc3cccc(Br)c3)nc2)c1
InChIInChI=1S/C19H15BrN2O3/c1-12-5-7-17(23)16(9-12)22-19(24)13-6-8-18(21-11-13)25-15-4-2-3-14(20)10-15/h2-11,23H,1H3,(H,22,24)
InChIKeyLWKILRHYOWNDCF-UHFFFAOYSA-N
MW399.24 g/mol
LogP4.90
Rot. Bonds4

About 6-(3-bromophenoxy)-N-(2-hydroxy-5-methylphenyl)pyridine-3-carboxamide

6-(3-bromophenoxy)-N-(2-hydroxy-5-methylphenyl)pyridine-3-carboxamide (PubChem CID 60562203) has the molecular formula C19H15BrN2O3 and a molecular weight of 399.24 g/mol. Its IUPAC name is 6-(3-bromophenoxy)-N-(2-hydroxy-5-methylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(3-bromophenoxy)-N-(2-hydroxy-5-methylphenyl)pyridine-3-carboxamide
PubChem CID60562203
Molecular FormulaC19H15BrN2O3
Molecular Weight399.24 g/mol
Exact Mass398.03
IUPAC Name6-(3-bromophenoxy)-N-(2-hydroxy-5-methylphenyl)pyridine-3-carboxamide
SMILESCc1ccc(O)c(NC(=O)c2ccc(Oc3cccc(Br)c3)nc2)c1
InChIInChI=1S/C19H15BrN2O3/c1-12-5-7-17(23)16(9-12)22-19(24)13-6-8-18(21-11-13)25-15-4-2-3-14(20)10-15/h2-11,23H,1H3,(H,22,24)
InChIKeyLWKILRHYOWNDCF-UHFFFAOYSA-N
XLogP4.90
TPSA71.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.24
LogP ≤ 54.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol', 'substructure': 'N/A'}

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Related Compounds

6-(3-bromophenoxy)-N-(5-fluoro-2-methylphenyl)pyridine-3-carboxamide
CID 46459917
6-(3-bromophenoxy)-N-(2-ethoxyphenyl)pyridine-3-carboxamide
CID 55699313
6-(3-bromophenoxy)-N-(2,4-dimethoxyphenyl)pyridine-3-carboxamide
CID 46458349
6-(3-bromophenoxy)-N-[2-(cyclopropylcarbamoyl)phenyl]pyridine-3-carboxamide
CID 46486838
6-(3-bromophenoxy)-N-(1-hydroxypropan-2-yl)pyridine-3-carboxamide
CID 78887929
6-(3-bromophenoxy)-N-(3-nitrophenyl)pyridine-3-carboxamide
CID 46458129
6-(3-bromophenoxy)-N-[3-(4-methyl-2,5-dioxoimidazolidin-4-yl)phenyl]pyridine-3-carboxamide
CID 55839599
6-(3-bromophenoxy)-N'-(2-chlorobenzoyl)pyridine-3-carbohydrazide
CID 55706653
N-[3-[[acetyl(methyl)amino]methyl]phenyl]-6-(3-bromophenoxy)pyridine-3-carboxamide
CID 55706261
6-(3-bromophenoxy)-N-[[4-(dimethylcarbamoyl)phenyl]methyl]pyridine-3-carboxamide
CID 55706775
6-(3-bromophenoxy)-N-piperidin-4-ylpyridine-3-carboxamide;dihydrochloride
CID 119388966
6-(4-bromophenoxy)-N-(4,5-dimethoxy-2-methylphenyl)pyridine-3-carboxamide
CID 55786958

Frequently Asked Questions

What is the IUPAC name of 6-(3-bromophenoxy)-N-(2-hydroxy-5-methylphenyl)pyridine-3-carboxamide?
The IUPAC name of 6-(3-bromophenoxy)-N-(2-hydroxy-5-methylphenyl)pyridine-3-carboxamide (CID 60562203) is 6-(3-bromophenoxy)-N-(2-hydroxy-5-methylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-(3-bromophenoxy)-N-(2-hydroxy-5-methylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 6-(3-bromophenoxy)-N-(2-hydroxy-5-methylphenyl)pyridine-3-carboxamide is Cc1ccc(O)c(NC(=O)c2ccc(Oc3cccc(Br)c3)nc2)c1.
What is the InChIKey of 6-(3-bromophenoxy)-N-(2-hydroxy-5-methylphenyl)pyridine-3-carboxamide?
The InChIKey is LWKILRHYOWNDCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15BrN2O3/c1-12-5-7-17(23)16(9-12)22-19(24)13-6-8-18(21-11-13)25-15-4-2-3-14(20)10-15/h2-11,23H,1H3,(H,22,24).
What are the key properties of 6-(3-bromophenoxy)-N-(2-hydroxy-5-methylphenyl)pyridine-3-carboxamide?
6-(3-bromophenoxy)-N-(2-hydroxy-5-methylphenyl)pyridine-3-carboxamide has a molecular weight of 399.24 g/mol, XLogP of 4.90, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-bromophenoxy)-N-(2-hydroxy-5-methylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 60562203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).