2-amino-5-bromo-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyridine-3-carboxamide

C12H13BrN4O2 — CID 106389722

IUPAC2-amino-5-bromo-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyridine-3-carboxamide
SMILESCc1cnc(C(C)NC(=O)c2cc(Br)cnc2N)o1
InChIInChI=1S/C12H13BrN4O2/c1-6-4-16-12(19-6)7(2)17-11(18)9-3-8(13)5-15-10(9)14/h3-5,7H,1-2H3,(H2,14,15)(H,17,18)
InChIKeyOUONNFPZVGPELE-UHFFFAOYSA-N
MW325.17 g/mol
LogP2.21
Rot. Bonds3

About 2-amino-5-bromo-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyridine-3-carboxamide

2-amino-5-bromo-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyridine-3-carboxamide (PubChem CID 106389722) has the molecular formula C12H13BrN4O2 and a molecular weight of 325.17 g/mol. Its IUPAC name is 2-amino-5-bromo-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-amino-5-bromo-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyridine-3-carboxamide
PubChem CID106389722
Molecular FormulaC12H13BrN4O2
Molecular Weight325.17 g/mol
Exact Mass324.02
IUPAC Name2-amino-5-bromo-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyridine-3-carboxamide
SMILESCc1cnc(C(C)NC(=O)c2cc(Br)cnc2N)o1
InChIInChI=1S/C12H13BrN4O2/c1-6-4-16-12(19-6)7(2)17-11(18)9-3-8(13)5-15-10(9)14/h3-5,7H,1-2H3,(H2,14,15)(H,17,18)
InChIKeyOUONNFPZVGPELE-UHFFFAOYSA-N
XLogP2.21
TPSA94.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.17
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-5-bromo-N-(3,3-dimethylbutan-2-yl)pyridine-3-carboxamide
CID 113458035
2-amino-5-bromo-N-(3-ethylpentan-2-yl)pyridine-3-carboxamide
CID 63837381
2-amino-5-bromo-N-pentan-2-ylpyridine-3-carboxamide
CID 62152326
4-bromo-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1H-pyrrole-2-carboxamide
CID 103948932
2-amino-4-methoxy-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]benzamide
CID 106388368
2-amino-5-bromo-N-[1-(2-chlorophenyl)ethyl]pyridine-3-carboxamide
CID 62160777
2-amino-5-bromo-N-[1-(2,4-dichlorophenyl)ethyl]pyridine-3-carboxamide
CID 63500588
4-amino-5-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]thiophene-2-carboxamide
CID 106387400
4-chloro-6-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyridine-3-carboxamide
CID 103949111
5-amino-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1,3,4-thiadiazole-2-carboxamide
CID 106389790
2-hydroxy-5-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]benzamide
CID 103949071
5-chloro-2-fluoro-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]benzamide
CID 103949119

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-bromo-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyridine-3-carboxamide?
The IUPAC name of 2-amino-5-bromo-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyridine-3-carboxamide (CID 106389722) is 2-amino-5-bromo-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyridine-3-carboxamide.
What is the SMILES notation for 2-amino-5-bromo-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyridine-3-carboxamide?
The canonical SMILES for 2-amino-5-bromo-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyridine-3-carboxamide is Cc1cnc(C(C)NC(=O)c2cc(Br)cnc2N)o1.
What is the InChIKey of 2-amino-5-bromo-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyridine-3-carboxamide?
The InChIKey is OUONNFPZVGPELE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13BrN4O2/c1-6-4-16-12(19-6)7(2)17-11(18)9-3-8(13)5-15-10(9)14/h3-5,7H,1-2H3,(H2,14,15)(H,17,18).
What are the key properties of 2-amino-5-bromo-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyridine-3-carboxamide?
2-amino-5-bromo-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyridine-3-carboxamide has a molecular weight of 325.17 g/mol, XLogP of 2.21, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-bromo-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyridine-3-carboxamide is sourced from PubChem (CID 106389722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).