2-bromo-N-[2-(4-methoxyphenoxy)-3-pyridinyl]benzamide

C19H15BrN2O3 — CID 55764139

IUPAC2-bromo-N-[2-(4-methoxyphenoxy)-3-pyridinyl]benzamide
SMILESCOc1ccc(Oc2ncccc2NC(=O)c2ccccc2Br)cc1
InChIInChI=1S/C19H15BrN2O3/c1-24-13-8-10-14(11-9-13)25-19-17(7-4-12-21-19)22-18(23)15-5-2-3-6-16(15)20/h2-12H,1H3,(H,22,23)
InChIKeyCGQHRZQDKSBIOX-UHFFFAOYSA-N
MW399.24 g/mol
LogP4.90
Rot. Bonds5

About 2-bromo-N-[2-(4-methoxyphenoxy)-3-pyridinyl]benzamide

2-bromo-N-[2-(4-methoxyphenoxy)-3-pyridinyl]benzamide (PubChem CID 55764139) has the molecular formula C19H15BrN2O3 and a molecular weight of 399.24 g/mol. Its IUPAC name is 2-bromo-N-[2-(4-methoxyphenoxy)-3-pyridinyl]benzamide.

Molecular Properties

Compound Name2-bromo-N-[2-(4-methoxyphenoxy)-3-pyridinyl]benzamide
PubChem CID55764139
Molecular FormulaC19H15BrN2O3
Molecular Weight399.24 g/mol
Exact Mass398.03
IUPAC Name2-bromo-N-[2-(4-methoxyphenoxy)-3-pyridinyl]benzamide
SMILESCOc1ccc(Oc2ncccc2NC(=O)c2ccccc2Br)cc1
InChIInChI=1S/C19H15BrN2O3/c1-24-13-8-10-14(11-9-13)25-19-17(7-4-12-21-19)22-18(23)15-5-2-3-6-16(15)20/h2-12H,1H3,(H,22,23)
InChIKeyCGQHRZQDKSBIOX-UHFFFAOYSA-N
XLogP4.90
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.24
LogP ≤ 54.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-bromophenyl)-2-methoxypyridine-3-carboxamide
CID 55023834
N-[2-(4-methoxyphenoxy)-3-pyridinyl]acetamide
CID 154411578
N-[2-(4-methoxyphenoxy)-3-pyridinyl]-2-methyl-3-nitrobenzamide
CID 55764079
2-chloro-N-[2-(4-methoxyphenoxy)-3-pyridinyl]-5-methylsulfonylbenzamide
CID 55763392
N-(4-methoxyphenyl)-2-phenoxypyridine-3-carboxamide
CID 24513637
N-[2-(4-methoxyphenoxy)-3-pyridinyl]-4-(trifluoromethoxy)benzamide
CID 2728304
N-[2-(4-methoxyphenoxy)-3-pyridinyl]-2-pyrimidin-2-yl-1,3-thiazole-4-carboxamide
CID 55873301
2-[(2-bromobenzoyl)amino]-N-[(4-methoxyphenyl)methyl]benzamide
CID 26549860
2-bromo-N-(2-methoxyphenyl)benzamide
CID 676344
N-[2-(4-methoxyphenoxy)-3-pyridinyl]-2-(4-methylphenoxy)acetamide
CID 55661128
N-[2-(4-methoxyphenoxy)-3-pyridinyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
CID 55663053
N-(2-bromo-5-methylphenyl)-2-methoxypyridine-3-carboxamide
CID 82707201

Frequently Asked Questions

What is the IUPAC name of 2-bromo-N-[2-(4-methoxyphenoxy)-3-pyridinyl]benzamide?
The IUPAC name of 2-bromo-N-[2-(4-methoxyphenoxy)-3-pyridinyl]benzamide (CID 55764139) is 2-bromo-N-[2-(4-methoxyphenoxy)-3-pyridinyl]benzamide.
What is the SMILES notation for 2-bromo-N-[2-(4-methoxyphenoxy)-3-pyridinyl]benzamide?
The canonical SMILES for 2-bromo-N-[2-(4-methoxyphenoxy)-3-pyridinyl]benzamide is COc1ccc(Oc2ncccc2NC(=O)c2ccccc2Br)cc1.
What is the InChIKey of 2-bromo-N-[2-(4-methoxyphenoxy)-3-pyridinyl]benzamide?
The InChIKey is CGQHRZQDKSBIOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15BrN2O3/c1-24-13-8-10-14(11-9-13)25-19-17(7-4-12-21-19)22-18(23)15-5-2-3-6-16(15)20/h2-12H,1H3,(H,22,23).
What are the key properties of 2-bromo-N-[2-(4-methoxyphenoxy)-3-pyridinyl]benzamide?
2-bromo-N-[2-(4-methoxyphenoxy)-3-pyridinyl]benzamide has a molecular weight of 399.24 g/mol, XLogP of 4.90, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-N-[2-(4-methoxyphenoxy)-3-pyridinyl]benzamide is sourced from PubChem (CID 55764139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).