2-amino-5-bromo-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-3-carboxamide

C10H14BrN3O2 — CID 155213563

IUPAC2-amino-5-bromo-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-3-carboxamide
SMILESCC(C)(CO)NC(=O)c1cc(Br)cnc1N
InChIInChI=1S/C10H14BrN3O2/c1-10(2,5-15)14-9(16)7-3-6(11)4-13-8(7)12/h3-4,15H,5H2,1-2H3,(H2,12,13)(H,14,16)
InChIKeyXKJRYDWPXHASTO-UHFFFAOYSA-N
MW288.14 g/mol
LogP0.93
Rot. Bonds3

About 2-amino-5-bromo-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-3-carboxamide

2-amino-5-bromo-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-3-carboxamide (PubChem CID 155213563) has the molecular formula C10H14BrN3O2 and a molecular weight of 288.14 g/mol. Its IUPAC name is 2-amino-5-bromo-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-amino-5-bromo-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-3-carboxamide
PubChem CID155213563
Molecular FormulaC10H14BrN3O2
Molecular Weight288.14 g/mol
Exact Mass287.03
IUPAC Name2-amino-5-bromo-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-3-carboxamide
SMILESCC(C)(CO)NC(=O)c1cc(Br)cnc1N
InChIInChI=1S/C10H14BrN3O2/c1-10(2,5-15)14-9(16)7-3-6(11)4-13-8(7)12/h3-4,15H,5H2,1-2H3,(H2,12,13)(H,14,16)
InChIKeyXKJRYDWPXHASTO-UHFFFAOYSA-N
XLogP0.93
TPSA88.24 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.14
LogP ≤ 50.93
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-5-bromo-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-3-carboxamide?
The IUPAC name of 2-amino-5-bromo-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-3-carboxamide (CID 155213563) is 2-amino-5-bromo-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-3-carboxamide.
What is the SMILES notation for 2-amino-5-bromo-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-3-carboxamide?
The canonical SMILES for 2-amino-5-bromo-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-3-carboxamide is CC(C)(CO)NC(=O)c1cc(Br)cnc1N.
What is the InChIKey of 2-amino-5-bromo-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-3-carboxamide?
The InChIKey is XKJRYDWPXHASTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14BrN3O2/c1-10(2,5-15)14-9(16)7-3-6(11)4-13-8(7)12/h3-4,15H,5H2,1-2H3,(H2,12,13)(H,14,16).
What are the key properties of 2-amino-5-bromo-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-3-carboxamide?
2-amino-5-bromo-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-3-carboxamide has a molecular weight of 288.14 g/mol, XLogP of 0.93, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-bromo-N-(1-hydroxy-2-methylpropan-2-yl)pyridine-3-carboxamide is sourced from PubChem (CID 155213563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).