N-(5-bromo-2-chlorophenyl)-2-(propylamino)pyridine-4-carboxamide

C15H15BrClN3O — CID 62909985

IUPACN-(5-bromo-2-chlorophenyl)-2-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cc(C(=O)Nc2cc(Br)ccc2Cl)ccn1
InChIInChI=1S/C15H15BrClN3O/c1-2-6-18-14-8-10(5-7-19-14)15(21)20-13-9-11(16)3-4-12(13)17/h3-5,7-9H,2,6H2,1H3,(H,18,19)(H,20,21)
InChIKeyAHNAHOJCYGRTHQ-UHFFFAOYSA-N
MW368.66 g/mol
LogP4.57
Rot. Bonds5

About N-(5-bromo-2-chlorophenyl)-2-(propylamino)pyridine-4-carboxamide

N-(5-bromo-2-chlorophenyl)-2-(propylamino)pyridine-4-carboxamide (PubChem CID 62909985) has the molecular formula C15H15BrClN3O and a molecular weight of 368.66 g/mol. Its IUPAC name is N-(5-bromo-2-chlorophenyl)-2-(propylamino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(5-bromo-2-chlorophenyl)-2-(propylamino)pyridine-4-carboxamide
PubChem CID62909985
Molecular FormulaC15H15BrClN3O
Molecular Weight368.66 g/mol
Exact Mass367.01
IUPAC NameN-(5-bromo-2-chlorophenyl)-2-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cc(C(=O)Nc2cc(Br)ccc2Cl)ccn1
InChIInChI=1S/C15H15BrClN3O/c1-2-6-18-14-8-10(5-7-19-14)15(21)20-13-9-11(16)3-4-12(13)17/h3-5,7-9H,2,6H2,1H3,(H,18,19)(H,20,21)
InChIKeyAHNAHOJCYGRTHQ-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

N-(5-bromo-2-fluorophenyl)-2-(propylamino)pyridine-4-carboxamide
CID 62170420
methyl 4-chloro-3-[[2-(propylamino)pyridine-4-carbonyl]amino]benzoate
CID 109165128
N-(5-bromo-2-chlorophenyl)-2-hydrazinylpyridine-4-carboxamide
CID 62908969
N-(2,4-dichlorophenyl)-2-(propylamino)pyridine-4-carboxamide
CID 62186931
N-(3-chloro-2-pyridinyl)-2-(propylamino)pyridine-4-carboxamide
CID 103094851
N-(2-chloro-6-methylphenyl)-2-(propylamino)pyridine-4-carboxamide
CID 66254887
N-methyl-2-(propylamino)pyridine-4-carboxamide
CID 62170975
N-(3-methyl-4-pyridinyl)-2-(propylamino)pyridine-4-carboxamide
CID 63670386
N-(4-bromo-2,6-dichlorophenyl)-2-(ethylamino)pyridine-4-carboxamide
CID 62166855
N-(2-chloro-4-methylphenyl)-2-(ethylamino)pyridine-4-carboxamide
CID 62165610
N-(3-methylphenyl)-2-(propylamino)pyridine-4-carboxamide
CID 62172134
N-(2,5-dibromophenyl)-2-(methylamino)pyridine-4-carboxamide
CID 55046905

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-2-chlorophenyl)-2-(propylamino)pyridine-4-carboxamide?
The IUPAC name of N-(5-bromo-2-chlorophenyl)-2-(propylamino)pyridine-4-carboxamide (CID 62909985) is N-(5-bromo-2-chlorophenyl)-2-(propylamino)pyridine-4-carboxamide.
What is the SMILES notation for N-(5-bromo-2-chlorophenyl)-2-(propylamino)pyridine-4-carboxamide?
The canonical SMILES for N-(5-bromo-2-chlorophenyl)-2-(propylamino)pyridine-4-carboxamide is CCCNc1cc(C(=O)Nc2cc(Br)ccc2Cl)ccn1.
What is the InChIKey of N-(5-bromo-2-chlorophenyl)-2-(propylamino)pyridine-4-carboxamide?
The InChIKey is AHNAHOJCYGRTHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrClN3O/c1-2-6-18-14-8-10(5-7-19-14)15(21)20-13-9-11(16)3-4-12(13)17/h3-5,7-9H,2,6H2,1H3,(H,18,19)(H,20,21).
What are the key properties of N-(5-bromo-2-chlorophenyl)-2-(propylamino)pyridine-4-carboxamide?
N-(5-bromo-2-chlorophenyl)-2-(propylamino)pyridine-4-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-(5-bromo-2-chlorophenyl)-2-(propylamino)pyridine-4-carboxamide is sourced from PubChem (CID 62909985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).