5-bromo-N-(3-cyanophenyl)-2-(ethylamino)pyridine-3-carboxamide

C15H13BrN4O — CID 62165850

IUPAC5-bromo-N-(3-cyanophenyl)-2-(ethylamino)pyridine-3-carboxamide
SMILESCCNc1ncc(Br)cc1C(=O)Nc1cccc(C#N)c1
InChIInChI=1S/C15H13BrN4O/c1-2-18-14-13(7-11(16)9-19-14)15(21)20-12-5-3-4-10(6-12)8-17/h3-7,9H,2H2,1H3,(H,18,19)(H,20,21)
InChIKeyABZUPKRWQWWSFH-UHFFFAOYSA-N
MW345.20 g/mol
LogP3.40
Rot. Bonds4

About 5-bromo-N-(3-cyanophenyl)-2-(ethylamino)pyridine-3-carboxamide

5-bromo-N-(3-cyanophenyl)-2-(ethylamino)pyridine-3-carboxamide (PubChem CID 62165850) has the molecular formula C15H13BrN4O and a molecular weight of 345.20 g/mol. Its IUPAC name is 5-bromo-N-(3-cyanophenyl)-2-(ethylamino)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-bromo-N-(3-cyanophenyl)-2-(ethylamino)pyridine-3-carboxamide
PubChem CID62165850
Molecular FormulaC15H13BrN4O
Molecular Weight345.20 g/mol
Exact Mass344.03
IUPAC Name5-bromo-N-(3-cyanophenyl)-2-(ethylamino)pyridine-3-carboxamide
SMILESCCNc1ncc(Br)cc1C(=O)Nc1cccc(C#N)c1
InChIInChI=1S/C15H13BrN4O/c1-2-18-14-13(7-11(16)9-19-14)15(21)20-12-5-3-4-10(6-12)8-17/h3-7,9H,2H2,1H3,(H,18,19)(H,20,21)
InChIKeyABZUPKRWQWWSFH-UHFFFAOYSA-N
XLogP3.40
TPSA77.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.20
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-bromo-N-(3-cyanophenyl)-2-(ethylamino)pyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(5-bromo-3-methyl-2-pyridinyl)-3-(3-cyanophenyl)urea
CID 83170863
5-bromo-N-(4-chloro-3-fluorophenyl)-2-(ethylamino)pyridine-3-carboxamide
CID 63501333
5-bromo-N-(5-bromo-3-methyl-2-pyridinyl)-2-(ethylamino)pyridine-3-carboxamide
CID 83169522
2,5-dibromo-N-(3-cyanophenyl)benzamide
CID 114369410
5-bromo-2-(ethylamino)-N-(2-fluorophenyl)pyridine-3-carboxamide
CID 62166744
5-bromo-N-(3-chloro-2-methylphenyl)-2-(ethylamino)pyridine-3-carboxamide
CID 62186772
5-bromo-N-(4-cyanophenyl)-2-hydrazinylpyridine-3-carboxamide
CID 62249046
5-bromo-2-(ethylamino)-N-(2-propan-2-ylpyrazol-3-yl)pyridine-3-carboxamide
CID 62184957
3-chloro-N-(3-cyanophenyl)-6-(ethylamino)pyridine-2-carboxamide
CID 62166201
5-bromo-2-(ethylamino)-N-(2-methylpyrazol-3-yl)pyridine-3-carboxamide
CID 62174779
5-bromo-N-(3-cyanophenyl)-2-(3-methylbutoxy)benzamide
CID 17350713
3-bromo-N-(3-cyanophenyl)-5-methylbenzamide
CID 113460579

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(3-cyanophenyl)-2-(ethylamino)pyridine-3-carboxamide?
The IUPAC name of 5-bromo-N-(3-cyanophenyl)-2-(ethylamino)pyridine-3-carboxamide (CID 62165850) is 5-bromo-N-(3-cyanophenyl)-2-(ethylamino)pyridine-3-carboxamide.
What is the SMILES notation for 5-bromo-N-(3-cyanophenyl)-2-(ethylamino)pyridine-3-carboxamide?
The canonical SMILES for 5-bromo-N-(3-cyanophenyl)-2-(ethylamino)pyridine-3-carboxamide is CCNc1ncc(Br)cc1C(=O)Nc1cccc(C#N)c1.
What is the InChIKey of 5-bromo-N-(3-cyanophenyl)-2-(ethylamino)pyridine-3-carboxamide?
The InChIKey is ABZUPKRWQWWSFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13BrN4O/c1-2-18-14-13(7-11(16)9-19-14)15(21)20-12-5-3-4-10(6-12)8-17/h3-7,9H,2H2,1H3,(H,18,19)(H,20,21).
What are the key properties of 5-bromo-N-(3-cyanophenyl)-2-(ethylamino)pyridine-3-carboxamide?
5-bromo-N-(3-cyanophenyl)-2-(ethylamino)pyridine-3-carboxamide has a molecular weight of 345.20 g/mol, XLogP of 3.40, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(3-cyanophenyl)-2-(ethylamino)pyridine-3-carboxamide is sourced from PubChem (CID 62165850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).