N-(4-bromo-3-chlorophenyl)-3-(ethylamino)pyridine-4-carboxamide

C14H13BrClN3O — CID 107616662

IUPACN-(4-bromo-3-chlorophenyl)-3-(ethylamino)pyridine-4-carboxamide
SMILESCCNc1cnccc1C(=O)Nc1ccc(Br)c(Cl)c1
InChIInChI=1S/C14H13BrClN3O/c1-2-18-13-8-17-6-5-10(13)14(20)19-9-3-4-11(15)12(16)7-9/h3-8,18H,2H2,1H3,(H,19,20)
InChIKeyGWXFUQXAGJSCDL-UHFFFAOYSA-N
MW354.64 g/mol
LogP4.18
Rot. Bonds4

About N-(4-bromo-3-chlorophenyl)-3-(ethylamino)pyridine-4-carboxamide

N-(4-bromo-3-chlorophenyl)-3-(ethylamino)pyridine-4-carboxamide (PubChem CID 107616662) has the molecular formula C14H13BrClN3O and a molecular weight of 354.64 g/mol. Its IUPAC name is N-(4-bromo-3-chlorophenyl)-3-(ethylamino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(4-bromo-3-chlorophenyl)-3-(ethylamino)pyridine-4-carboxamide
PubChem CID107616662
Molecular FormulaC14H13BrClN3O
Molecular Weight354.64 g/mol
Exact Mass352.99
IUPAC NameN-(4-bromo-3-chlorophenyl)-3-(ethylamino)pyridine-4-carboxamide
SMILESCCNc1cnccc1C(=O)Nc1ccc(Br)c(Cl)c1
InChIInChI=1S/C14H13BrClN3O/c1-2-18-13-8-17-6-5-10(13)14(20)19-9-3-4-11(15)12(16)7-9/h3-8,18H,2H2,1H3,(H,19,20)
InChIKeyGWXFUQXAGJSCDL-UHFFFAOYSA-N
XLogP4.18
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.64
LogP ≤ 54.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-bromo-4-chlorophenyl)-4-(ethylamino)pyridine-3-carboxamide
CID 81245404
N-(3,5-difluorophenyl)-3-(ethylamino)pyridine-4-carboxamide
CID 105068357
N-(2-chloro-4-methylphenyl)-3-(ethylamino)pyridine-4-carboxamide
CID 105068441
N-(4-ethoxyphenyl)-3-(ethylamino)pyridine-4-carboxamide
CID 105067886
N-(3-bromo-4-fluorophenyl)-3-(propylamino)pyridine-4-carboxamide
CID 105071177
3-(ethylamino)-N-thiophen-3-ylpyridine-4-carboxamide
CID 105070563
N-(2,5-dibromophenyl)-3-(propylamino)pyridine-4-carboxamide
CID 105069309
4-(ethylamino)-N-(4-fluorophenyl)pyridine-3-carboxamide
CID 81236169
N-[(2-chlorophenyl)methyl]-3-(ethylamino)pyridine-4-carboxamide
CID 105067967
N-(4-bromo-3-chlorophenyl)-6-(propylamino)pyridine-3-carboxamide
CID 107616648
N-(2-bromo-3-chlorophenyl)-3-(propylamino)pyridine-4-carboxamide
CID 103481422
N-(3-bromo-4-chlorophenyl)-5-(ethylamino)pyridine-2-carboxamide
CID 104641780

Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-3-chlorophenyl)-3-(ethylamino)pyridine-4-carboxamide?
The IUPAC name of N-(4-bromo-3-chlorophenyl)-3-(ethylamino)pyridine-4-carboxamide (CID 107616662) is N-(4-bromo-3-chlorophenyl)-3-(ethylamino)pyridine-4-carboxamide.
What is the SMILES notation for N-(4-bromo-3-chlorophenyl)-3-(ethylamino)pyridine-4-carboxamide?
The canonical SMILES for N-(4-bromo-3-chlorophenyl)-3-(ethylamino)pyridine-4-carboxamide is CCNc1cnccc1C(=O)Nc1ccc(Br)c(Cl)c1.
What is the InChIKey of N-(4-bromo-3-chlorophenyl)-3-(ethylamino)pyridine-4-carboxamide?
The InChIKey is GWXFUQXAGJSCDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13BrClN3O/c1-2-18-13-8-17-6-5-10(13)14(20)19-9-3-4-11(15)12(16)7-9/h3-8,18H,2H2,1H3,(H,19,20).
What are the key properties of N-(4-bromo-3-chlorophenyl)-3-(ethylamino)pyridine-4-carboxamide?
N-(4-bromo-3-chlorophenyl)-3-(ethylamino)pyridine-4-carboxamide has a molecular weight of 354.64 g/mol, XLogP of 4.18, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromo-3-chlorophenyl)-3-(ethylamino)pyridine-4-carboxamide is sourced from PubChem (CID 107616662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).