N-(4-bromo-2,6-dichlorophenyl)-2-(ethylamino)pyridine-4-carboxamide

C14H12BrCl2N3O — CID 62166855

IUPACN-(4-bromo-2,6-dichlorophenyl)-2-(ethylamino)pyridine-4-carboxamide
SMILESCCNc1cc(C(=O)Nc2c(Cl)cc(Br)cc2Cl)ccn1
InChIInChI=1S/C14H12BrCl2N3O/c1-2-18-12-5-8(3-4-19-12)14(21)20-13-10(16)6-9(15)7-11(13)17/h3-7H,2H2,1H3,(H,18,19)(H,20,21)
InChIKeyROZNWDGSQLUPLS-UHFFFAOYSA-N
MW389.08 g/mol
LogP4.84
Rot. Bonds4

About N-(4-bromo-2,6-dichlorophenyl)-2-(ethylamino)pyridine-4-carboxamide

N-(4-bromo-2,6-dichlorophenyl)-2-(ethylamino)pyridine-4-carboxamide (PubChem CID 62166855) has the molecular formula C14H12BrCl2N3O and a molecular weight of 389.08 g/mol. Its IUPAC name is N-(4-bromo-2,6-dichlorophenyl)-2-(ethylamino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(4-bromo-2,6-dichlorophenyl)-2-(ethylamino)pyridine-4-carboxamide
PubChem CID62166855
Molecular FormulaC14H12BrCl2N3O
Molecular Weight389.08 g/mol
Exact Mass386.95
IUPAC NameN-(4-bromo-2,6-dichlorophenyl)-2-(ethylamino)pyridine-4-carboxamide
SMILESCCNc1cc(C(=O)Nc2c(Cl)cc(Br)cc2Cl)ccn1
InChIInChI=1S/C14H12BrCl2N3O/c1-2-18-12-5-8(3-4-19-12)14(21)20-13-10(16)6-9(15)7-11(13)17/h3-7H,2H2,1H3,(H,18,19)(H,20,21)
InChIKeyROZNWDGSQLUPLS-UHFFFAOYSA-N
XLogP4.84
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.08
LogP ≤ 54.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-bromo-2,6-difluorophenyl)-2-(ethylamino)pyridine-4-carboxamide
CID 65499839
N-(2-chloro-4-methylphenyl)-2-(ethylamino)pyridine-4-carboxamide
CID 62165610
N-(4-bromo-2,6-dichlorophenyl)-6-(ethylamino)pyridazine-3-carboxamide
CID 62167008
N-(4-bromo-3,5-dimethylphenyl)-2-(ethylamino)pyridine-4-carboxamide
CID 107578271
N-(3-chloro-4-fluorophenyl)-2-(ethylamino)pyridine-4-carboxamide
CID 62166984
2-(ethylamino)-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide
CID 62184923
N-(5-bromo-6-methyl-2-pyridinyl)-2-(ethylamino)pyridine-4-carboxamide
CID 79049066
N-(3-chloro-4-cyanophenyl)-2-(ethylamino)pyridine-4-carboxamide
CID 62165803
N-(5-bromo-2-chlorophenyl)-2-(propylamino)pyridine-4-carboxamide
CID 62909985
2-(ethylamino)-N-(4-iodophenyl)pyridine-4-carboxamide
CID 62166650
2-(ethylamino)-N-(2-ethylphenyl)pyridine-4-carboxamide
CID 62165184
2-(ethylamino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-4-carboxamide
CID 62167570

Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-2,6-dichlorophenyl)-2-(ethylamino)pyridine-4-carboxamide?
The IUPAC name of N-(4-bromo-2,6-dichlorophenyl)-2-(ethylamino)pyridine-4-carboxamide (CID 62166855) is N-(4-bromo-2,6-dichlorophenyl)-2-(ethylamino)pyridine-4-carboxamide.
What is the SMILES notation for N-(4-bromo-2,6-dichlorophenyl)-2-(ethylamino)pyridine-4-carboxamide?
The canonical SMILES for N-(4-bromo-2,6-dichlorophenyl)-2-(ethylamino)pyridine-4-carboxamide is CCNc1cc(C(=O)Nc2c(Cl)cc(Br)cc2Cl)ccn1.
What is the InChIKey of N-(4-bromo-2,6-dichlorophenyl)-2-(ethylamino)pyridine-4-carboxamide?
The InChIKey is ROZNWDGSQLUPLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12BrCl2N3O/c1-2-18-12-5-8(3-4-19-12)14(21)20-13-10(16)6-9(15)7-11(13)17/h3-7H,2H2,1H3,(H,18,19)(H,20,21).
What are the key properties of N-(4-bromo-2,6-dichlorophenyl)-2-(ethylamino)pyridine-4-carboxamide?
N-(4-bromo-2,6-dichlorophenyl)-2-(ethylamino)pyridine-4-carboxamide has a molecular weight of 389.08 g/mol, XLogP of 4.84, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromo-2,6-dichlorophenyl)-2-(ethylamino)pyridine-4-carboxamide is sourced from PubChem (CID 62166855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).