N-(4-bromo-2-ethylphenyl)-6-(methylamino)pyridine-2-carboxamide

C15H16BrN3O — CID 81287386

IUPACN-(4-bromo-2-ethylphenyl)-6-(methylamino)pyridine-2-carboxamide
SMILESCCc1cc(Br)ccc1NC(=O)c1cccc(NC)n1
InChIInChI=1S/C15H16BrN3O/c1-3-10-9-11(16)7-8-12(10)19-15(20)13-5-4-6-14(17-2)18-13/h4-9H,3H2,1-2H3,(H,17,18)(H,19,20)
InChIKeyYGHNMXNLEDDKDC-UHFFFAOYSA-N
MW334.22 g/mol
LogP3.70
Rot. Bonds4

About N-(4-bromo-2-ethylphenyl)-6-(methylamino)pyridine-2-carboxamide

N-(4-bromo-2-ethylphenyl)-6-(methylamino)pyridine-2-carboxamide (PubChem CID 81287386) has the molecular formula C15H16BrN3O and a molecular weight of 334.22 g/mol. Its IUPAC name is N-(4-bromo-2-ethylphenyl)-6-(methylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(4-bromo-2-ethylphenyl)-6-(methylamino)pyridine-2-carboxamide
PubChem CID81287386
Molecular FormulaC15H16BrN3O
Molecular Weight334.22 g/mol
Exact Mass333.05
IUPAC NameN-(4-bromo-2-ethylphenyl)-6-(methylamino)pyridine-2-carboxamide
SMILESCCc1cc(Br)ccc1NC(=O)c1cccc(NC)n1
InChIInChI=1S/C15H16BrN3O/c1-3-10-9-11(16)7-8-12(10)19-15(20)13-5-4-6-14(17-2)18-13/h4-9H,3H2,1-2H3,(H,17,18)(H,19,20)
InChIKeyYGHNMXNLEDDKDC-UHFFFAOYSA-N
XLogP3.70
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.22
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-bromo-2-ethylphenyl)-2-chloro-6-(methylamino)pyridine-4-carboxamide
CID 80999398
N-(5-bromo-2-cyanophenyl)-6-(methylamino)pyridine-2-carboxamide
CID 107801255
N-(5-bromo-2-pyridinyl)-6-(methylamino)pyridine-2-carboxamide
CID 62238936
N-(3-bromo-2-methylphenyl)-6-(methylamino)pyridine-2-carboxamide
CID 107630995
N-(4-bromo-2-ethylphenyl)-2H-triazole-4-carboxamide
CID 81003417
N-(4-bromo-2-ethylphenyl)-2,3-dihydroxybenzamide
CID 114343713
N-(2-chlorophenyl)-6-(methylamino)pyridine-2-carboxamide
CID 62241147
N-(2,5-dimethylphenyl)-6-(methylamino)pyridine-2-carboxamide
CID 62239438
6-(ethylamino)-N-(2-ethylphenyl)pyridine-2-carboxamide
CID 62240641
N-(4-bromo-2-ethylphenyl)-3-chloro-2-methylbenzamide
CID 107096920
N-(5-bromo-2-cyanophenyl)-6-(ethylamino)pyridine-2-carboxamide
CID 107801225
2-bromo-N-(4-bromo-2-ethylphenyl)-3-methylbenzamide
CID 103855381

Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-2-ethylphenyl)-6-(methylamino)pyridine-2-carboxamide?
The IUPAC name of N-(4-bromo-2-ethylphenyl)-6-(methylamino)pyridine-2-carboxamide (CID 81287386) is N-(4-bromo-2-ethylphenyl)-6-(methylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-(4-bromo-2-ethylphenyl)-6-(methylamino)pyridine-2-carboxamide?
The canonical SMILES for N-(4-bromo-2-ethylphenyl)-6-(methylamino)pyridine-2-carboxamide is CCc1cc(Br)ccc1NC(=O)c1cccc(NC)n1.
What is the InChIKey of N-(4-bromo-2-ethylphenyl)-6-(methylamino)pyridine-2-carboxamide?
The InChIKey is YGHNMXNLEDDKDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16BrN3O/c1-3-10-9-11(16)7-8-12(10)19-15(20)13-5-4-6-14(17-2)18-13/h4-9H,3H2,1-2H3,(H,17,18)(H,19,20).
What are the key properties of N-(4-bromo-2-ethylphenyl)-6-(methylamino)pyridine-2-carboxamide?
N-(4-bromo-2-ethylphenyl)-6-(methylamino)pyridine-2-carboxamide has a molecular weight of 334.22 g/mol, XLogP of 3.70, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromo-2-ethylphenyl)-6-(methylamino)pyridine-2-carboxamide is sourced from PubChem (CID 81287386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).