2-(5-bromo-2-oxo-1-pyridinyl)-N-[2-(methylamino)ethyl]acetamide

C10H14BrN3O2 — CID 119503564

IUPAC2-(5-bromo-2-oxo-1-pyridinyl)-N-[2-(methylamino)ethyl]acetamide
SMILESCNCCNC(=O)Cn1cc(Br)ccc1=O
InChIInChI=1S/C10H14BrN3O2/c1-12-4-5-13-9(15)7-14-6-8(11)2-3-10(14)16/h2-3,6,12H,4-5,7H2,1H3,(H,13,15)
InChIKeyVCUNOXXWRSGGTE-UHFFFAOYSA-N
MW288.14 g/mol
LogP-0.05
Rot. Bonds5

About 2-(5-bromo-2-oxo-1-pyridinyl)-N-[2-(methylamino)ethyl]acetamide

2-(5-bromo-2-oxo-1-pyridinyl)-N-[2-(methylamino)ethyl]acetamide (PubChem CID 119503564) has the molecular formula C10H14BrN3O2 and a molecular weight of 288.14 g/mol. Its IUPAC name is 2-(5-bromo-2-oxo-1-pyridinyl)-N-[2-(methylamino)ethyl]acetamide.

Molecular Properties

Compound Name2-(5-bromo-2-oxo-1-pyridinyl)-N-[2-(methylamino)ethyl]acetamide
PubChem CID119503564
Molecular FormulaC10H14BrN3O2
Molecular Weight288.14 g/mol
Exact Mass287.03
IUPAC Name2-(5-bromo-2-oxo-1-pyridinyl)-N-[2-(methylamino)ethyl]acetamide
SMILESCNCCNC(=O)Cn1cc(Br)ccc1=O
InChIInChI=1S/C10H14BrN3O2/c1-12-4-5-13-9(15)7-14-6-8(11)2-3-10(14)16/h2-3,6,12H,4-5,7H2,1H3,(H,13,15)
InChIKeyVCUNOXXWRSGGTE-UHFFFAOYSA-N
XLogP-0.05
TPSA63.13 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.14
LogP ≤ 5-0.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[[2-(5-bromo-2-oxo-1-pyridinyl)acetyl]amino]-N-propylacetamide
CID 78815021
(2S)-4-[[2-(5-bromo-2-oxo-1-pyridinyl)acetyl]amino]-2-hydroxybutanoic acid
CID 114006601
3-[[2-(5-bromo-2-oxo-1-pyridinyl)acetyl]amino]-N-(4-bromophenyl)propanamide
CID 55951719
methyl 7-[[2-(5-bromo-2-oxo-1-pyridinyl)acetyl]amino]heptanoate
CID 86979311
2-[[2-[[2-(5-bromo-2-oxo-1-pyridinyl)acetyl]amino]acetyl]amino]acetic acid
CID 43465461
2-(5-bromo-2-oxo-1-pyridinyl)-N-(2-phenoxyethyl)acetamide
CID 51209692
2-(5-bromo-2-oxo-1-pyridinyl)-N-(3-phenylsulfanylpropyl)acetamide
CID 37343566
5-bromo-1-[3-(methylamino)propyl]pyridin-2-one
CID 61387594
2-(5-bromo-2-oxo-1-pyridinyl)-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]acetamide
CID 64547769
5-bromo-1-[2-(methylaminomethyl)prop-2-enyl]pyridin-2-one
CID 103071702
2-(5-bromo-2-oxo-1-pyridinyl)-N-cyanoacetamide
CID 79194945
2-(5-bromo-2-oxo-1-pyridinyl)-N-(2-cyclopentyl-2-hydroxyethyl)acetamide
CID 111425720

Frequently Asked Questions

What is the IUPAC name of 2-(5-bromo-2-oxo-1-pyridinyl)-N-[2-(methylamino)ethyl]acetamide?
The IUPAC name of 2-(5-bromo-2-oxo-1-pyridinyl)-N-[2-(methylamino)ethyl]acetamide (CID 119503564) is 2-(5-bromo-2-oxo-1-pyridinyl)-N-[2-(methylamino)ethyl]acetamide.
What is the SMILES notation for 2-(5-bromo-2-oxo-1-pyridinyl)-N-[2-(methylamino)ethyl]acetamide?
The canonical SMILES for 2-(5-bromo-2-oxo-1-pyridinyl)-N-[2-(methylamino)ethyl]acetamide is CNCCNC(=O)Cn1cc(Br)ccc1=O.
What is the InChIKey of 2-(5-bromo-2-oxo-1-pyridinyl)-N-[2-(methylamino)ethyl]acetamide?
The InChIKey is VCUNOXXWRSGGTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14BrN3O2/c1-12-4-5-13-9(15)7-14-6-8(11)2-3-10(14)16/h2-3,6,12H,4-5,7H2,1H3,(H,13,15).
What are the key properties of 2-(5-bromo-2-oxo-1-pyridinyl)-N-[2-(methylamino)ethyl]acetamide?
2-(5-bromo-2-oxo-1-pyridinyl)-N-[2-(methylamino)ethyl]acetamide has a molecular weight of 288.14 g/mol, XLogP of -0.05, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-bromo-2-oxo-1-pyridinyl)-N-[2-(methylamino)ethyl]acetamide is sourced from PubChem (CID 119503564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).