5-bromo-N-(1-hydroxy-2-methylbutan-2-yl)pyridine-2-carboxamide

C11H15BrN2O2 — CID 64555627

IUPAC5-bromo-N-(1-hydroxy-2-methylbutan-2-yl)pyridine-2-carboxamide
SMILESCCC(C)(CO)NC(=O)c1ccc(Br)cn1
InChIInChI=1S/C11H15BrN2O2/c1-3-11(2,7-15)14-10(16)9-5-4-8(12)6-13-9/h4-6,15H,3,7H2,1-2H3,(H,14,16)
InChIKeyHQSGJVLGVMDOPP-UHFFFAOYSA-N
MW287.16 g/mol
LogP1.73
Rot. Bonds4

About 5-bromo-N-(1-hydroxy-2-methylbutan-2-yl)pyridine-2-carboxamide

5-bromo-N-(1-hydroxy-2-methylbutan-2-yl)pyridine-2-carboxamide (PubChem CID 64555627) has the molecular formula C11H15BrN2O2 and a molecular weight of 287.16 g/mol. Its IUPAC name is 5-bromo-N-(1-hydroxy-2-methylbutan-2-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-bromo-N-(1-hydroxy-2-methylbutan-2-yl)pyridine-2-carboxamide
PubChem CID64555627
Molecular FormulaC11H15BrN2O2
Molecular Weight287.16 g/mol
Exact Mass286.03
IUPAC Name5-bromo-N-(1-hydroxy-2-methylbutan-2-yl)pyridine-2-carboxamide
SMILESCCC(C)(CO)NC(=O)c1ccc(Br)cn1
InChIInChI=1S/C11H15BrN2O2/c1-3-11(2,7-15)14-10(16)9-5-4-8(12)6-13-9/h4-6,15H,3,7H2,1-2H3,(H,14,16)
InChIKeyHQSGJVLGVMDOPP-UHFFFAOYSA-N
XLogP1.73
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.16
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-N-(1-bromo-3-methylpentan-3-yl)pyridine-2-carboxamide
CID 106169604
5-bromo-N-[3-(hydroxymethyl)pentan-3-yl]pyridine-2-carboxamide
CID 55153816
2-[(5-bromopyridine-2-carbonyl)amino]-2-methylpentanoic acid
CID 62958243
3-[(5-bromopyridine-2-carbonyl)amino]-4-methoxy-3-methylbutanoic acid
CID 120532186
2-[(5-bromopyridine-2-carbonyl)amino]-3,3,3-trifluoro-2-methylpropanoic acid
CID 79793016
5-carbamothioyl-N-(3-methylpentan-3-yl)pyridine-2-carboxamide
CID 106329081
2-[(5-bromo-2-pyridinyl)methylamino]-2-methylbutan-1-ol
CID 64550786
5-bromo-N-[2-(bromomethyl)-2-ethylbutyl]pyridine-2-carboxamide
CID 106255667
5-bromo-N-(2-methyl-4-phenylbutan-2-yl)pyridine-2-carboxamide
CID 115606439
3-[(5-bromopyridine-2-carbonyl)amino]-2,2-dimethylpropanoic acid
CID 115427045
N-(1-amino-2-cyclopropylpropan-2-yl)-5-bromopyridine-2-carboxamide;dihydrochloride
CID 119573907
5-amino-N-(2-methylbutan-2-yl)pyridine-2-carboxamide
CID 81319675

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(1-hydroxy-2-methylbutan-2-yl)pyridine-2-carboxamide?
The IUPAC name of 5-bromo-N-(1-hydroxy-2-methylbutan-2-yl)pyridine-2-carboxamide (CID 64555627) is 5-bromo-N-(1-hydroxy-2-methylbutan-2-yl)pyridine-2-carboxamide.
What is the SMILES notation for 5-bromo-N-(1-hydroxy-2-methylbutan-2-yl)pyridine-2-carboxamide?
The canonical SMILES for 5-bromo-N-(1-hydroxy-2-methylbutan-2-yl)pyridine-2-carboxamide is CCC(C)(CO)NC(=O)c1ccc(Br)cn1.
What is the InChIKey of 5-bromo-N-(1-hydroxy-2-methylbutan-2-yl)pyridine-2-carboxamide?
The InChIKey is HQSGJVLGVMDOPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15BrN2O2/c1-3-11(2,7-15)14-10(16)9-5-4-8(12)6-13-9/h4-6,15H,3,7H2,1-2H3,(H,14,16).
What are the key properties of 5-bromo-N-(1-hydroxy-2-methylbutan-2-yl)pyridine-2-carboxamide?
5-bromo-N-(1-hydroxy-2-methylbutan-2-yl)pyridine-2-carboxamide has a molecular weight of 287.16 g/mol, XLogP of 1.73, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(1-hydroxy-2-methylbutan-2-yl)pyridine-2-carboxamide is sourced from PubChem (CID 64555627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).