5-bromo-N-(4-ethoxy-3-methoxyphenyl)pyridine-2-carboxamide

C15H15BrN2O3 — CID 62952861

IUPAC5-bromo-N-(4-ethoxy-3-methoxyphenyl)pyridine-2-carboxamide
SMILESCCOc1ccc(NC(=O)c2ccc(Br)cn2)cc1OC
InChIInChI=1S/C15H15BrN2O3/c1-3-21-13-7-5-11(8-14(13)20-2)18-15(19)12-6-4-10(16)9-17-12/h4-9H,3H2,1-2H3,(H,18,19)
InChIKeyOZPMMKXMNNIQHH-UHFFFAOYSA-N
MW351.20 g/mol
LogP3.50
Rot. Bonds5

About 5-bromo-N-(4-ethoxy-3-methoxyphenyl)pyridine-2-carboxamide

5-bromo-N-(4-ethoxy-3-methoxyphenyl)pyridine-2-carboxamide (PubChem CID 62952861) has the molecular formula C15H15BrN2O3 and a molecular weight of 351.20 g/mol. Its IUPAC name is 5-bromo-N-(4-ethoxy-3-methoxyphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-bromo-N-(4-ethoxy-3-methoxyphenyl)pyridine-2-carboxamide
PubChem CID62952861
Molecular FormulaC15H15BrN2O3
Molecular Weight351.20 g/mol
Exact Mass350.03
IUPAC Name5-bromo-N-(4-ethoxy-3-methoxyphenyl)pyridine-2-carboxamide
SMILESCCOc1ccc(NC(=O)c2ccc(Br)cn2)cc1OC
InChIInChI=1S/C15H15BrN2O3/c1-3-21-13-7-5-11(8-14(13)20-2)18-15(19)12-6-4-10(16)9-17-12/h4-9H,3H2,1-2H3,(H,18,19)
InChIKeyOZPMMKXMNNIQHH-UHFFFAOYSA-N
XLogP3.50
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.20
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-bromo-N-(3-bromo-4-methoxyphenyl)pyridine-2-carboxamide
CID 63999815
4-bromo-N-(4-ethoxy-3-methoxyphenyl)-1H-pyrrole-2-carboxamide
CID 17459532
1-N,4-N-bis(4-ethoxy-3-methoxyphenyl)benzene-1,4-dicarboxamide
CID 24645019
N-(3-bromo-4-methoxyphenyl)-5-(ethylamino)pyridine-2-carboxamide
CID 104641623
N-(4-ethoxy-3-methoxyphenyl)-2,4,5-trimethoxybenzamide
CID 9103295
6-bromo-N-(3-ethoxy-4-methoxyphenyl)pyridine-2-carboxamide
CID 103889781
4-bromo-N-[2-(4-ethoxy-3-methoxyanilino)-2-oxoethyl]benzamide
CID 9102895
N-(4-ethoxy-3-methoxyphenyl)-6-fluoropyridine-3-carboxamide
CID 63973929
5-bromo-N-(2-chloro-4,5-dimethoxyphenyl)pyridine-2-carboxamide
CID 62954749
2-(4-bromophenyl)sulfanyl-N-(4-ethoxy-3-methoxyphenyl)acetamide
CID 9102401
N-(3,4-diethoxyphenyl)pyrazine-2-carboxamide
CID 4882744
2-chloro-N-(4-ethoxy-3-methoxyphenyl)propanamide
CID 43346919

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(4-ethoxy-3-methoxyphenyl)pyridine-2-carboxamide?
The IUPAC name of 5-bromo-N-(4-ethoxy-3-methoxyphenyl)pyridine-2-carboxamide (CID 62952861) is 5-bromo-N-(4-ethoxy-3-methoxyphenyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-bromo-N-(4-ethoxy-3-methoxyphenyl)pyridine-2-carboxamide?
The canonical SMILES for 5-bromo-N-(4-ethoxy-3-methoxyphenyl)pyridine-2-carboxamide is CCOc1ccc(NC(=O)c2ccc(Br)cn2)cc1OC.
What is the InChIKey of 5-bromo-N-(4-ethoxy-3-methoxyphenyl)pyridine-2-carboxamide?
The InChIKey is OZPMMKXMNNIQHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrN2O3/c1-3-21-13-7-5-11(8-14(13)20-2)18-15(19)12-6-4-10(16)9-17-12/h4-9H,3H2,1-2H3,(H,18,19).
What are the key properties of 5-bromo-N-(4-ethoxy-3-methoxyphenyl)pyridine-2-carboxamide?
5-bromo-N-(4-ethoxy-3-methoxyphenyl)pyridine-2-carboxamide has a molecular weight of 351.20 g/mol, XLogP of 3.50, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(4-ethoxy-3-methoxyphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 62952861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).