6-bromo-N-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-ylquinoline-4-carboxamide

C19H13BrN4O2 — CID 2220680

IUPAC6-bromo-N-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-ylquinoline-4-carboxamide
SMILESCc1cc(NC(=O)c2cc(-c3ccccn3)nc3ccc(Br)cc23)no1
InChIInChI=1S/C19H13BrN4O2/c1-11-8-18(24-26-11)23-19(25)14-10-17(16-4-2-3-7-21-16)22-15-6-5-12(20)9-13(14)15/h2-10H,1H3,(H,23,24,25)
InChIKeyFASGRBHQPDMHLH-UHFFFAOYSA-N
MW409.24 g/mol
LogP4.61
Rot. Bonds3

About 6-bromo-N-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-ylquinoline-4-carboxamide

6-bromo-N-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-ylquinoline-4-carboxamide (PubChem CID 2220680) has the molecular formula C19H13BrN4O2 and a molecular weight of 409.24 g/mol. Its IUPAC name is 6-bromo-N-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-ylquinoline-4-carboxamide.

Molecular Properties

Compound Name6-bromo-N-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-ylquinoline-4-carboxamide
PubChem CID2220680
Molecular FormulaC19H13BrN4O2
Molecular Weight409.24 g/mol
Exact Mass408.02
IUPAC Name6-bromo-N-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-ylquinoline-4-carboxamide
SMILESCc1cc(NC(=O)c2cc(-c3ccccn3)nc3ccc(Br)cc23)no1
InChIInChI=1S/C19H13BrN4O2/c1-11-8-18(24-26-11)23-19(25)14-10-17(16-4-2-3-7-21-16)22-15-6-5-12(20)9-13(14)15/h2-10H,1H3,(H,23,24,25)
InChIKeyFASGRBHQPDMHLH-UHFFFAOYSA-N
XLogP4.61
TPSA80.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500409.24
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6,8-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-ylquinoline-4-carboxamide
CID 1261395
2-(4-bromophenyl)-N-(5-methyl-1,2-oxazol-3-yl)quinoline-4-carboxamide
CID 1358287
6-methyl-N-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-3-ylquinoline-4-carboxamide
CID 17371985
N-(5-methyl-1H-pyrazol-3-yl)-2-pyridin-2-ylquinoline-4-carboxamide
CID 4793520
N-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-3-ylquinoline-4-carboxamide
CID 155910501
N-(4-bromo-2-fluorophenyl)-2-pyridin-2-ylquinoline-4-carboxamide
CID 39315313
N-[(2S)-3,3-dimethylbutan-2-yl]-6-methyl-2-pyridin-2-ylquinoline-4-carboxamide
CID 899137
2-(4-ethylphenyl)-N-(5-methyl-1,2-oxazol-3-yl)quinoline-4-carboxamide
CID 4095752
6-bromo-N-[2-(2-methoxyphenyl)ethyl]-2-pyridin-2-ylquinoline-4-carboxamide
CID 1261404
N-(5-methyl-1,2-oxazol-3-yl)-2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxamide
CID 2329897
N-(5-methyl-1,2-oxazol-3-yl)benzamide
CID 569560
6-bromo-N-(1H-inden-2-ylmethyl)-2-pyridin-2-ylquinoline-4-carboxamide
CID 149460373

Frequently Asked Questions

What is the IUPAC name of 6-bromo-N-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-ylquinoline-4-carboxamide?
The IUPAC name of 6-bromo-N-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-ylquinoline-4-carboxamide (CID 2220680) is 6-bromo-N-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-ylquinoline-4-carboxamide.
What is the SMILES notation for 6-bromo-N-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-ylquinoline-4-carboxamide?
The canonical SMILES for 6-bromo-N-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-ylquinoline-4-carboxamide is Cc1cc(NC(=O)c2cc(-c3ccccn3)nc3ccc(Br)cc23)no1.
What is the InChIKey of 6-bromo-N-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-ylquinoline-4-carboxamide?
The InChIKey is FASGRBHQPDMHLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13BrN4O2/c1-11-8-18(24-26-11)23-19(25)14-10-17(16-4-2-3-7-21-16)22-15-6-5-12(20)9-13(14)15/h2-10H,1H3,(H,23,24,25).
What are the key properties of 6-bromo-N-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-ylquinoline-4-carboxamide?
6-bromo-N-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-ylquinoline-4-carboxamide has a molecular weight of 409.24 g/mol, XLogP of 4.61, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-N-(5-methyl-1,2-oxazol-3-yl)-2-pyridin-2-ylquinoline-4-carboxamide is sourced from PubChem (CID 2220680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).