N-(4-bromo-3-methoxyphenyl)-2-(methylamino)pyridine-4-carboxamide

C14H14BrN3O2 — CID 82859455

IUPACN-(4-bromo-3-methoxyphenyl)-2-(methylamino)pyridine-4-carboxamide
SMILESCNc1cc(C(=O)Nc2ccc(Br)c(OC)c2)ccn1
InChIInChI=1S/C14H14BrN3O2/c1-16-13-7-9(5-6-17-13)14(19)18-10-3-4-11(15)12(8-10)20-2/h3-8H,1-2H3,(H,16,17)(H,18,19)
InChIKeyWLTYXICEUZWNDO-UHFFFAOYSA-N
MW336.19 g/mol
LogP3.15
Rot. Bonds4

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

N-(4-bromo-3-methoxyphenyl)-2-(methylamino)pyridine-4-carboxamide (PubChem CID 82859455) has the molecular formula C14H14BrN3O2 and a molecular weight of 336.19 g/mol. Its IUPAC name is N-(4-bromo-3-methoxyphenyl)-2-(methylamino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(4-bromo-3-methoxyphenyl)-2-(methylamino)pyridine-4-carboxamide
PubChem CID82859455
Molecular FormulaC14H14BrN3O2
Molecular Weight336.19 g/mol
Exact Mass335.03
IUPAC NameN-(4-bromo-3-methoxyphenyl)-2-(methylamino)pyridine-4-carboxamide
SMILESCNc1cc(C(=O)Nc2ccc(Br)c(OC)c2)ccn1
InChIInChI=1S/C14H14BrN3O2/c1-16-13-7-9(5-6-17-13)14(19)18-10-3-4-11(15)12(8-10)20-2/h3-8H,1-2H3,(H,16,17)(H,18,19)
InChIKeyWLTYXICEUZWNDO-UHFFFAOYSA-N
XLogP3.15
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.19
LogP ≤ 53.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(4-bromo-3-methoxyphenyl)-2-(methylamino)pyridine-4-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

N-(4-bromo-3-methoxyphenyl)-2-hydrazinylpyridine-4-carboxamide
CID 82860502
2-(methylamino)-N-(2-methyl-4-pyridinyl)pyridine-4-carboxamide
CID 79240155
N-(4-bromo-3-methoxyphenyl)-6-(methylamino)pyridazine-3-carboxamide
CID 82860303
N-(3,5-dimethylphenyl)-2-(methylamino)pyridine-4-carboxamide
CID 62167632
3,5-dibromo-N-(4-bromo-3-methoxyphenyl)benzamide
CID 107980534
3-bromo-N-(4-bromo-3-methoxyphenyl)benzamide
CID 79421204
N-(2,5-dibromophenyl)-2-(methylamino)pyridine-4-carboxamide
CID 55046905
4-bromo-N-(4-bromo-3-methoxyphenyl)-3-fluorobenzamide
CID 82867341
N-(5-bromo-6-methyl-2-pyridinyl)-2-(methylamino)pyridine-4-carboxamide
CID 79049145
N-(3-bromo-4-methoxyphenyl)pyridine-4-carboxamide
CID 110776808
2-(aminomethyl)-N-(3-bromo-4-methoxyphenyl)pyridine-4-carboxamide
CID 114326705
N-(4-bromo-3-methylphenyl)-2-methoxypyridine-4-carboxamide
CID 110863112

Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-3-methoxyphenyl)-2-(methylamino)pyridine-4-carboxamide?
The IUPAC name of N-(4-bromo-3-methoxyphenyl)-2-(methylamino)pyridine-4-carboxamide (CID 82859455) is N-(4-bromo-3-methoxyphenyl)-2-(methylamino)pyridine-4-carboxamide.
What is the SMILES notation for N-(4-bromo-3-methoxyphenyl)-2-(methylamino)pyridine-4-carboxamide?
The canonical SMILES for N-(4-bromo-3-methoxyphenyl)-2-(methylamino)pyridine-4-carboxamide is CNc1cc(C(=O)Nc2ccc(Br)c(OC)c2)ccn1.
What is the InChIKey of N-(4-bromo-3-methoxyphenyl)-2-(methylamino)pyridine-4-carboxamide?
The InChIKey is WLTYXICEUZWNDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14BrN3O2/c1-16-13-7-9(5-6-17-13)14(19)18-10-3-4-11(15)12(8-10)20-2/h3-8H,1-2H3,(H,16,17)(H,18,19).
What are the key properties of N-(4-bromo-3-methoxyphenyl)-2-(methylamino)pyridine-4-carboxamide?
N-(4-bromo-3-methoxyphenyl)-2-(methylamino)pyridine-4-carboxamide has a molecular weight of 336.19 g/mol, XLogP of 3.15, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromo-3-methoxyphenyl)-2-(methylamino)pyridine-4-carboxamide is sourced from PubChem (CID 82859455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).