2-[(5-amino-3-bromo-2-pyridinyl)-ethylamino]-N-methylacetamide

C10H15BrN4O — CID 79531786

IUPAC2-[(5-amino-3-bromo-2-pyridinyl)-ethylamino]-N-methylacetamide
SMILESCCN(CC(=O)NC)c1ncc(N)cc1Br
InChIInChI=1S/C10H15BrN4O/c1-3-15(6-9(16)13-2)10-8(11)4-7(12)5-14-10/h4-5H,3,6,12H2,1-2H3,(H,13,16)
InChIKeyCXQYXJKQGIYYDV-UHFFFAOYSA-N
MW287.16 g/mol
LogP1.00
Rot. Bonds4

About 2-[(5-amino-3-bromo-2-pyridinyl)-ethylamino]-N-methylacetamide

2-[(5-amino-3-bromo-2-pyridinyl)-ethylamino]-N-methylacetamide (PubChem CID 79531786) has the molecular formula C10H15BrN4O and a molecular weight of 287.16 g/mol. Its IUPAC name is 2-[(5-amino-3-bromo-2-pyridinyl)-ethylamino]-N-methylacetamide.

Molecular Properties

Compound Name2-[(5-amino-3-bromo-2-pyridinyl)-ethylamino]-N-methylacetamide
PubChem CID79531786
Molecular FormulaC10H15BrN4O
Molecular Weight287.16 g/mol
Exact Mass286.04
IUPAC Name2-[(5-amino-3-bromo-2-pyridinyl)-ethylamino]-N-methylacetamide
SMILESCCN(CC(=O)NC)c1ncc(N)cc1Br
InChIInChI=1S/C10H15BrN4O/c1-3-15(6-9(16)13-2)10-8(11)4-7(12)5-14-10/h4-5H,3,6,12H2,1-2H3,(H,13,16)
InChIKeyCXQYXJKQGIYYDV-UHFFFAOYSA-N
XLogP1.00
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.16
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[(5-amino-3-bromo-2-pyridinyl)-ethylamino]-N-methylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-amino-2-[ethyl-[2-(methylamino)-2-oxoethyl]amino]pyridine-3-carboxamide
CID 61359374
ethyl 2-[(3-bromo-5-methyl-2-pyridinyl)-ethylamino]acetate
CID 105368549
2-[(5-amino-3-bromo-2-pyridinyl)-methylamino]-N,N-diethylacetamide
CID 79531880
5-amino-2-[(2-amino-2-oxoethyl)-ethylamino]pyridine-3-carboxamide
CID 103101079
2-[ethyl-[3-methyl-5-(methylaminomethyl)-2-pyridinyl]amino]-N-methylacetamide
CID 80629627
2-[ethyl-[2-(methylamino)-2-oxoethyl]amino]-5-fluoropyridine-3-carboxylic acid
CID 114034395
2-[(3-bromo-5-chloro-2-pyridinyl)-ethylamino]acetamide
CID 103103965
2-N-benzyl-3-bromo-2-N-ethylpyridine-2,5-diamine
CID 79532190
5-amino-2-(diethylamino)pyridine-3-carboxamide
CID 61359746
2-[(2-amino-5-fluoropyrimidin-4-yl)-ethylamino]-N-methylacetamide
CID 80808590
3-bromo-2-N,2-N-bis(2-methylpropyl)pyridine-2,5-diamine
CID 79531788
5-amino-2-[[2-(dimethylamino)-2-oxoethyl]-ethylamino]pyridine-3-carboxylic acid
CID 114047069

Frequently Asked Questions

What is the IUPAC name of 2-[(5-amino-3-bromo-2-pyridinyl)-ethylamino]-N-methylacetamide?
The IUPAC name of 2-[(5-amino-3-bromo-2-pyridinyl)-ethylamino]-N-methylacetamide (CID 79531786) is 2-[(5-amino-3-bromo-2-pyridinyl)-ethylamino]-N-methylacetamide.
What is the SMILES notation for 2-[(5-amino-3-bromo-2-pyridinyl)-ethylamino]-N-methylacetamide?
The canonical SMILES for 2-[(5-amino-3-bromo-2-pyridinyl)-ethylamino]-N-methylacetamide is CCN(CC(=O)NC)c1ncc(N)cc1Br.
What is the InChIKey of 2-[(5-amino-3-bromo-2-pyridinyl)-ethylamino]-N-methylacetamide?
The InChIKey is CXQYXJKQGIYYDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15BrN4O/c1-3-15(6-9(16)13-2)10-8(11)4-7(12)5-14-10/h4-5H,3,6,12H2,1-2H3,(H,13,16).
What are the key properties of 2-[(5-amino-3-bromo-2-pyridinyl)-ethylamino]-N-methylacetamide?
2-[(5-amino-3-bromo-2-pyridinyl)-ethylamino]-N-methylacetamide has a molecular weight of 287.16 g/mol, XLogP of 1.00, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-amino-3-bromo-2-pyridinyl)-ethylamino]-N-methylacetamide is sourced from PubChem (CID 79531786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).