N-(5-bromo-2-pyridinyl)-2-(methylamino)acetamide

C8H10BrN3O — CID 43089366

IUPACN-(5-bromo-2-pyridinyl)-2-(methylamino)acetamide
SMILESCNCC(=O)Nc1ccc(Br)cn1
InChIInChI=1S/C8H10BrN3O/c1-10-5-8(13)12-7-3-2-6(9)4-11-7/h2-4,10H,5H2,1H3,(H,11,12,13)
InChIKeyZPKMZTAFTFNGDE-UHFFFAOYSA-N
MW244.09 g/mol
LogP1.00
Rot. Bonds3

About N-(5-bromo-2-pyridinyl)-2-(methylamino)acetamide

N-(5-bromo-2-pyridinyl)-2-(methylamino)acetamide (PubChem CID 43089366) has the molecular formula C8H10BrN3O and a molecular weight of 244.09 g/mol. Its IUPAC name is N-(5-bromo-2-pyridinyl)-2-(methylamino)acetamide.

Molecular Properties

Compound NameN-(5-bromo-2-pyridinyl)-2-(methylamino)acetamide
PubChem CID43089366
Molecular FormulaC8H10BrN3O
Molecular Weight244.09 g/mol
Exact Mass243.00
IUPAC NameN-(5-bromo-2-pyridinyl)-2-(methylamino)acetamide
SMILESCNCC(=O)Nc1ccc(Br)cn1
InChIInChI=1S/C8H10BrN3O/c1-10-5-8(13)12-7-3-2-6(9)4-11-7/h2-4,10H,5H2,1H3,(H,11,12,13)
InChIKeyZPKMZTAFTFNGDE-UHFFFAOYSA-N
XLogP1.00
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.09
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-2-pyridinyl)-2-(methylamino)acetamide?
The IUPAC name of N-(5-bromo-2-pyridinyl)-2-(methylamino)acetamide (CID 43089366) is N-(5-bromo-2-pyridinyl)-2-(methylamino)acetamide.
What is the SMILES notation for N-(5-bromo-2-pyridinyl)-2-(methylamino)acetamide?
The canonical SMILES for N-(5-bromo-2-pyridinyl)-2-(methylamino)acetamide is CNCC(=O)Nc1ccc(Br)cn1.
What is the InChIKey of N-(5-bromo-2-pyridinyl)-2-(methylamino)acetamide?
The InChIKey is ZPKMZTAFTFNGDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10BrN3O/c1-10-5-8(13)12-7-3-2-6(9)4-11-7/h2-4,10H,5H2,1H3,(H,11,12,13).
What are the key properties of N-(5-bromo-2-pyridinyl)-2-(methylamino)acetamide?
N-(5-bromo-2-pyridinyl)-2-(methylamino)acetamide has a molecular weight of 244.09 g/mol, XLogP of 1.00, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-2-pyridinyl)-2-(methylamino)acetamide is sourced from PubChem (CID 43089366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).