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

C15H16BrN3O — CID 109223122

IUPACN-(2-bromophenyl)-5-(propylamino)pyridine-3-carboxamide
SMILESCCCNc1cncc(C(=O)Nc2ccccc2Br)c1
InChIInChI=1S/C15H16BrN3O/c1-2-7-18-12-8-11(9-17-10-12)15(20)19-14-6-4-3-5-13(14)16/h3-6,8-10,18H,2,7H2,1H3,(H,19,20)
InChIKeyFNEUQLZVNCZHNC-UHFFFAOYSA-N
MW334.22 g/mol
LogP3.92
Rot. Bonds5

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

N-(2-bromophenyl)-5-(propylamino)pyridine-3-carboxamide (PubChem CID 109223122) has the molecular formula C15H16BrN3O and a molecular weight of 334.22 g/mol. Its IUPAC name is N-(2-bromophenyl)-5-(propylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-bromophenyl)-5-(propylamino)pyridine-3-carboxamide
PubChem CID109223122
Molecular FormulaC15H16BrN3O
Molecular Weight334.22 g/mol
Exact Mass333.05
IUPAC NameN-(2-bromophenyl)-5-(propylamino)pyridine-3-carboxamide
SMILESCCCNc1cncc(C(=O)Nc2ccccc2Br)c1
InChIInChI=1S/C15H16BrN3O/c1-2-7-18-12-8-11(9-17-10-12)15(20)19-14-6-4-3-5-13(14)16/h3-6,8-10,18H,2,7H2,1H3,(H,19,20)
InChIKeyFNEUQLZVNCZHNC-UHFFFAOYSA-N
XLogP3.92
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.22
LogP ≤ 53.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-fluorophenyl)-5-(propylamino)pyridine-3-carboxamide
CID 109223073
5-(propylamino)-N-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide
CID 109223099
methyl 2-[[5-(propylamino)pyridine-3-carbonyl]amino]benzoate
CID 109223106
N-(2-propan-2-yloxyphenyl)-5-(propylamino)pyridine-3-carboxamide
CID 109223094
5-(butylamino)-N-(2-fluorophenyl)pyridine-3-carboxamide
CID 109224645
N-(3,5-dimethylphenyl)-5-(propylamino)pyridine-3-carboxamide
CID 109223059
N-(2-bromophenyl)-5-(dipropylamino)pyridine-3-carboxamide
CID 109241090
N-(2-bromophenyl)-5-chloro-6-(propylamino)pyridine-3-carboxamide
CID 62166024
N-(2-bromophenyl)-5-(diethylamino)pyridine-3-carboxamide
CID 109238971
5-(propylamino)-N-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide
CID 109223100
N-(2-bromophenyl)-5-phenylpyridine-3-carboxamide
CID 99705381
5-(propylamino)-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide
CID 109223068

Frequently Asked Questions

What is the IUPAC name of N-(2-bromophenyl)-5-(propylamino)pyridine-3-carboxamide?
The IUPAC name of N-(2-bromophenyl)-5-(propylamino)pyridine-3-carboxamide (CID 109223122) is N-(2-bromophenyl)-5-(propylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(2-bromophenyl)-5-(propylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(2-bromophenyl)-5-(propylamino)pyridine-3-carboxamide is CCCNc1cncc(C(=O)Nc2ccccc2Br)c1.
What is the InChIKey of N-(2-bromophenyl)-5-(propylamino)pyridine-3-carboxamide?
The InChIKey is FNEUQLZVNCZHNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16BrN3O/c1-2-7-18-12-8-11(9-17-10-12)15(20)19-14-6-4-3-5-13(14)16/h3-6,8-10,18H,2,7H2,1H3,(H,19,20).
What are the key properties of N-(2-bromophenyl)-5-(propylamino)pyridine-3-carboxamide?
N-(2-bromophenyl)-5-(propylamino)pyridine-3-carboxamide has a molecular weight of 334.22 g/mol, XLogP of 3.92, 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-(propylamino)pyridine-3-carboxamide is sourced from PubChem (CID 109223122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).