6-(4-bromoanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide

C16H13BrN4O2 — CID 109163837

IUPAC6-(4-bromoanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide
SMILESCc1cc(NC(=O)c2ccc(Nc3ccc(Br)cc3)nc2)no1
InChIInChI=1S/C16H13BrN4O2/c1-10-8-15(21-23-10)20-16(22)11-2-7-14(18-9-11)19-13-5-3-12(17)4-6-13/h2-9H,1H3,(H,18,19)(H,20,21,22)
InChIKeyMQYGBORJTFINIK-UHFFFAOYSA-N
MW373.21 g/mol
LogP4.14
Rot. Bonds4

About 6-(4-bromoanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide

6-(4-bromoanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide (PubChem CID 109163837) has the molecular formula C16H13BrN4O2 and a molecular weight of 373.21 g/mol. Its IUPAC name is 6-(4-bromoanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(4-bromoanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide
PubChem CID109163837
Molecular FormulaC16H13BrN4O2
Molecular Weight373.21 g/mol
Exact Mass372.02
IUPAC Name6-(4-bromoanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide
SMILESCc1cc(NC(=O)c2ccc(Nc3ccc(Br)cc3)nc2)no1
InChIInChI=1S/C16H13BrN4O2/c1-10-8-15(21-23-10)20-16(22)11-2-7-14(18-9-11)19-13-5-3-12(17)4-6-13/h2-9H,1H3,(H,18,19)(H,20,21,22)
InChIKeyMQYGBORJTFINIK-UHFFFAOYSA-N
XLogP4.14
TPSA80.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.21
LogP ≤ 54.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-bromoanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyrimidine-5-carboxamide
CID 109269397
N-(4-acetamidophenyl)-6-[(5-methyl-1,2-oxazol-3-yl)amino]pyridine-3-carboxamide
CID 109164581
N-(3,4-dichlorophenyl)-6-[(5-methyl-1,2-oxazol-3-yl)amino]pyridine-3-carboxamide
CID 109164919
6-[(5-methyl-1,2-oxazol-3-yl)amino]-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 109164309
2-(4-chloroanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyrimidine-5-carboxamide
CID 109268924
N-[5-[(5-methyl-1,2-oxazol-3-yl)amino]-2-pyridinyl]benzamide
CID 113037667
6-(2-tert-butylanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide
CID 109163139
2-(4-bromophenyl)-N-[6-[(5-methyl-1,2-oxazol-3-yl)amino]-3-pyridinyl]acetamide
CID 113023353
6-(2,5-dimethoxyanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide
CID 109164323
N-(4-bromophenyl)-2-[(5-methyl-1,2-oxazol-3-yl)amino]pyridine-4-carboxamide
CID 109177861
4-(methylamino)-N-(5-methyl-1,2-oxazol-3-yl)benzamide
CID 62165645
6-(4-bromoanilino)-N-(4-cyanophenyl)pyridine-3-carboxamide
CID 109163836

Frequently Asked Questions

What is the IUPAC name of 6-(4-bromoanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide?
The IUPAC name of 6-(4-bromoanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide (CID 109163837) is 6-(4-bromoanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide.
What is the SMILES notation for 6-(4-bromoanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide?
The canonical SMILES for 6-(4-bromoanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide is Cc1cc(NC(=O)c2ccc(Nc3ccc(Br)cc3)nc2)no1.
What is the InChIKey of 6-(4-bromoanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide?
The InChIKey is MQYGBORJTFINIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13BrN4O2/c1-10-8-15(21-23-10)20-16(22)11-2-7-14(18-9-11)19-13-5-3-12(17)4-6-13/h2-9H,1H3,(H,18,19)(H,20,21,22).
What are the key properties of 6-(4-bromoanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide?
6-(4-bromoanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide has a molecular weight of 373.21 g/mol, XLogP of 4.14, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-bromoanilino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide is sourced from PubChem (CID 109163837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).