N-(1-aminopentan-2-yl)-5-bromopyridine-3-carboxamide

C11H16BrN3O — CID 65191484

IUPACN-(1-aminopentan-2-yl)-5-bromopyridine-3-carboxamide
SMILESCCCC(CN)NC(=O)c1cncc(Br)c1
InChIInChI=1S/C11H16BrN3O/c1-2-3-10(5-13)15-11(16)8-4-9(12)7-14-6-8/h4,6-7,10H,2-3,5,13H2,1H3,(H,15,16)
InChIKeyFSZNDNXPRFIVGN-UHFFFAOYSA-N
MW286.17 g/mol
LogP1.70
Rot. Bonds5

About N-(1-aminopentan-2-yl)-5-bromopyridine-3-carboxamide

N-(1-aminopentan-2-yl)-5-bromopyridine-3-carboxamide (PubChem CID 65191484) has the molecular formula C11H16BrN3O and a molecular weight of 286.17 g/mol. Its IUPAC name is N-(1-aminopentan-2-yl)-5-bromopyridine-3-carboxamide.

Molecular Properties

Compound NameN-(1-aminopentan-2-yl)-5-bromopyridine-3-carboxamide
PubChem CID65191484
Molecular FormulaC11H16BrN3O
Molecular Weight286.17 g/mol
Exact Mass285.05
IUPAC NameN-(1-aminopentan-2-yl)-5-bromopyridine-3-carboxamide
SMILESCCCC(CN)NC(=O)c1cncc(Br)c1
InChIInChI=1S/C11H16BrN3O/c1-2-3-10(5-13)15-11(16)8-4-9(12)7-14-6-8/h4,6-7,10H,2-3,5,13H2,1H3,(H,15,16)
InChIKeyFSZNDNXPRFIVGN-UHFFFAOYSA-N
XLogP1.70
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.17
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-amino-3-methylbutan-2-yl)-5-bromopyridine-3-carboxamide
CID 65191624
N-(1-aminopentan-2-yl)-3-bromo-5-methylbenzamide
CID 115999655
2-[(5-bromopyridine-3-carbonyl)amino]pentanoic acid
CID 43630361
diethyl 2-[(5-bromopyridine-3-carbonyl)amino]propanedioate
CID 33240132
5-bromo-N-(5-methylhexan-2-yl)pyridine-3-carboxamide
CID 60628143
N-(1-aminopentan-2-yl)-4-bromo-3-fluorobenzamide
CID 65190911
N-(1-aminohexan-2-yl)-3-bromo-5-fluorobenzamide
CID 80696821
5-bromo-N-(1-methylsulfanylpropan-2-yl)pyridine-3-carboxamide
CID 115636073
N-(2-amino-1-cyclopentylethyl)-5-bromopyridine-3-carboxamide
CID 106737450
(2R)-2-[(5-bromopyridine-3-carbonyl)amino]propanoic acid
CID 28979301
5-bromo-N-(3-hydroxybutan-2-yl)pyridine-3-carboxamide
CID 131048375
N-(1-aminopentan-2-yl)-2-methylpyridine-4-carboxamide
CID 106753662

Frequently Asked Questions

What is the IUPAC name of N-(1-aminopentan-2-yl)-5-bromopyridine-3-carboxamide?
The IUPAC name of N-(1-aminopentan-2-yl)-5-bromopyridine-3-carboxamide (CID 65191484) is N-(1-aminopentan-2-yl)-5-bromopyridine-3-carboxamide.
What is the SMILES notation for N-(1-aminopentan-2-yl)-5-bromopyridine-3-carboxamide?
The canonical SMILES for N-(1-aminopentan-2-yl)-5-bromopyridine-3-carboxamide is CCCC(CN)NC(=O)c1cncc(Br)c1.
What is the InChIKey of N-(1-aminopentan-2-yl)-5-bromopyridine-3-carboxamide?
The InChIKey is FSZNDNXPRFIVGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16BrN3O/c1-2-3-10(5-13)15-11(16)8-4-9(12)7-14-6-8/h4,6-7,10H,2-3,5,13H2,1H3,(H,15,16).
What are the key properties of N-(1-aminopentan-2-yl)-5-bromopyridine-3-carboxamide?
N-(1-aminopentan-2-yl)-5-bromopyridine-3-carboxamide has a molecular weight of 286.17 g/mol, XLogP of 1.70, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-aminopentan-2-yl)-5-bromopyridine-3-carboxamide is sourced from PubChem (CID 65191484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).