N-(2-bromophenyl)-5-chloro-6-(propylamino)pyridine-3-carboxamide

C15H15BrClN3O — CID 62166024

IUPACN-(2-bromophenyl)-5-chloro-6-(propylamino)pyridine-3-carboxamide
SMILESCCCNc1ncc(C(=O)Nc2ccccc2Br)cc1Cl
InChIInChI=1S/C15H15BrClN3O/c1-2-7-18-14-12(17)8-10(9-19-14)15(21)20-13-6-4-3-5-11(13)16/h3-6,8-9H,2,7H2,1H3,(H,18,19)(H,20,21)
InChIKeyJAYYFEYPGJMWGY-UHFFFAOYSA-N
MW368.66 g/mol
LogP4.57
Rot. Bonds5

About N-(2-bromophenyl)-5-chloro-6-(propylamino)pyridine-3-carboxamide

N-(2-bromophenyl)-5-chloro-6-(propylamino)pyridine-3-carboxamide (PubChem CID 62166024) has the molecular formula C15H15BrClN3O and a molecular weight of 368.66 g/mol. Its IUPAC name is N-(2-bromophenyl)-5-chloro-6-(propylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-bromophenyl)-5-chloro-6-(propylamino)pyridine-3-carboxamide
PubChem CID62166024
Molecular FormulaC15H15BrClN3O
Molecular Weight368.66 g/mol
Exact Mass367.01
IUPAC NameN-(2-bromophenyl)-5-chloro-6-(propylamino)pyridine-3-carboxamide
SMILESCCCNc1ncc(C(=O)Nc2ccccc2Br)cc1Cl
InChIInChI=1S/C15H15BrClN3O/c1-2-7-18-14-12(17)8-10(9-19-14)15(21)20-13-6-4-3-5-11(13)16/h3-6,8-9H,2,7H2,1H3,(H,18,19)(H,20,21)
InChIKeyJAYYFEYPGJMWGY-UHFFFAOYSA-N
XLogP4.57
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.66
LogP ≤ 54.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-N-(3-chlorophenyl)-6-(propylamino)pyridine-3-carboxamide
CID 25176417
N-(2-bromophenyl)-5-(propylamino)pyridine-3-carboxamide
CID 109223122
5-chloro-N-(6-methyl-2-pyridinyl)-6-(propylamino)pyridine-3-carboxamide
CID 62170701
5-chloro-6-(propylamino)-N-thiophen-3-ylpyridine-3-carboxamide
CID 66355264
N-tert-butyl-5-chloro-6-(propylamino)pyridine-3-carboxamide
CID 62171459
5-chloro-N-cyclobutyl-6-(propylamino)pyridine-3-carboxamide
CID 62414075
N-(2-bromophenyl)-3-chloro-6-(propylamino)pyridine-2-carboxamide
CID 62165496
N-(5-bromo-2-fluorophenyl)-5-chloro-6-(ethylamino)pyridine-3-carboxamide
CID 62168364
5-chloro-6-(propylamino)-N-(2,2,2-trifluoroethyl)pyridine-3-carboxamide
CID 62172627
4-N-(2-bromophenyl)-1-N-propylbenzene-1,4-dicarboxamide
CID 109043031
6-N-(2-bromophenyl)-3,5-dichloro-2-N-propylpyridine-2,6-diamine
CID 102755127
N-(5-amino-5-oxopentyl)-5-chloro-6-(propylamino)pyridine-3-carboxamide
CID 106241047

Frequently Asked Questions

What is the IUPAC name of N-(2-bromophenyl)-5-chloro-6-(propylamino)pyridine-3-carboxamide?
The IUPAC name of N-(2-bromophenyl)-5-chloro-6-(propylamino)pyridine-3-carboxamide (CID 62166024) is N-(2-bromophenyl)-5-chloro-6-(propylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(2-bromophenyl)-5-chloro-6-(propylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(2-bromophenyl)-5-chloro-6-(propylamino)pyridine-3-carboxamide is CCCNc1ncc(C(=O)Nc2ccccc2Br)cc1Cl.
What is the InChIKey of N-(2-bromophenyl)-5-chloro-6-(propylamino)pyridine-3-carboxamide?
The InChIKey is JAYYFEYPGJMWGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrClN3O/c1-2-7-18-14-12(17)8-10(9-19-14)15(21)20-13-6-4-3-5-11(13)16/h3-6,8-9H,2,7H2,1H3,(H,18,19)(H,20,21).
What are the key properties of N-(2-bromophenyl)-5-chloro-6-(propylamino)pyridine-3-carboxamide?
N-(2-bromophenyl)-5-chloro-6-(propylamino)pyridine-3-carboxamide has a molecular weight of 368.66 g/mol, XLogP of 4.57, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromophenyl)-5-chloro-6-(propylamino)pyridine-3-carboxamide is sourced from PubChem (CID 62166024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).