N-(2,6-dibromophenyl)-6-(propylamino)pyridine-3-carboxamide

C15H15Br2N3O — CID 107603238

IUPACN-(2,6-dibromophenyl)-6-(propylamino)pyridine-3-carboxamide
SMILESCCCNc1ccc(C(=O)Nc2c(Br)cccc2Br)cn1
InChIInChI=1S/C15H15Br2N3O/c1-2-8-18-13-7-6-10(9-19-13)15(21)20-14-11(16)4-3-5-12(14)17/h3-7,9H,2,8H2,1H3,(H,18,19)(H,20,21)
InChIKeyPVNLQEWLHPBQSN-UHFFFAOYSA-N
MW413.11 g/mol
LogP4.68
Rot. Bonds5

About N-(2,6-dibromophenyl)-6-(propylamino)pyridine-3-carboxamide

N-(2,6-dibromophenyl)-6-(propylamino)pyridine-3-carboxamide (PubChem CID 107603238) has the molecular formula C15H15Br2N3O and a molecular weight of 413.11 g/mol. Its IUPAC name is N-(2,6-dibromophenyl)-6-(propylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2,6-dibromophenyl)-6-(propylamino)pyridine-3-carboxamide
PubChem CID107603238
Molecular FormulaC15H15Br2N3O
Molecular Weight413.11 g/mol
Exact Mass410.96
IUPAC NameN-(2,6-dibromophenyl)-6-(propylamino)pyridine-3-carboxamide
SMILESCCCNc1ccc(C(=O)Nc2c(Br)cccc2Br)cn1
InChIInChI=1S/C15H15Br2N3O/c1-2-8-18-13-7-6-10(9-19-13)15(21)20-14-11(16)4-3-5-12(14)17/h3-7,9H,2,8H2,1H3,(H,18,19)(H,20,21)
InChIKeyPVNLQEWLHPBQSN-UHFFFAOYSA-N
XLogP4.68
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500413.11
LogP ≤ 54.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-(propylamino)-N-pyrimidin-2-ylpyridine-3-carboxamide
CID 62172448
N-(4-bromo-3-chlorophenyl)-6-(propylamino)pyridine-3-carboxamide
CID 107616648
N-(2-iodophenyl)-6-(propylamino)pyridine-3-carboxamide
CID 62166866
N-(2,3-difluorophenyl)-6-(propylamino)pyridine-3-carboxamide
CID 62181665
N-(3-chloro-2-fluorophenyl)-6-(propylamino)pyridine-3-carboxamide
CID 62166291
N',N'-dimethyl-6-(propylamino)pyridine-3-carbohydrazide
CID 83024179
N-(2,6-dibromophenyl)-6-fluoropyridine-3-carboxamide
CID 107598690
N-(2-bromo-6-fluorophenyl)-4-(propylamino)benzamide
CID 107603351
N-(3,4-difluorophenyl)-6-(propylamino)pyridine-3-carboxamide
CID 62166701
N-(2-bromophenyl)-6-(3-methoxypropylamino)pyridine-3-carboxamide
CID 109153234
N-(2-bromophenyl)-6-[3-(dimethylamino)propylamino]pyridine-3-carboxamide
CID 109154344
N-(cyclobutylmethyl)-6-(propylamino)pyridine-3-carboxamide
CID 62168464

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dibromophenyl)-6-(propylamino)pyridine-3-carboxamide?
The IUPAC name of N-(2,6-dibromophenyl)-6-(propylamino)pyridine-3-carboxamide (CID 107603238) is N-(2,6-dibromophenyl)-6-(propylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(2,6-dibromophenyl)-6-(propylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(2,6-dibromophenyl)-6-(propylamino)pyridine-3-carboxamide is CCCNc1ccc(C(=O)Nc2c(Br)cccc2Br)cn1.
What is the InChIKey of N-(2,6-dibromophenyl)-6-(propylamino)pyridine-3-carboxamide?
The InChIKey is PVNLQEWLHPBQSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15Br2N3O/c1-2-8-18-13-7-6-10(9-19-13)15(21)20-14-11(16)4-3-5-12(14)17/h3-7,9H,2,8H2,1H3,(H,18,19)(H,20,21).
What are the key properties of N-(2,6-dibromophenyl)-6-(propylamino)pyridine-3-carboxamide?
N-(2,6-dibromophenyl)-6-(propylamino)pyridine-3-carboxamide has a molecular weight of 413.11 g/mol, XLogP of 4.68, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dibromophenyl)-6-(propylamino)pyridine-3-carboxamide is sourced from PubChem (CID 107603238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).