2-[(5-bromo-4-methyl-2-pyridinyl)amino]-N,N-dimethylacetamide

C10H14BrN3O — CID 115773852

IUPAC2-[(5-bromo-4-methyl-2-pyridinyl)amino]-N,N-dimethylacetamide
SMILESCc1cc(NCC(=O)N(C)C)ncc1Br
InChIInChI=1S/C10H14BrN3O/c1-7-4-9(12-5-8(7)11)13-6-10(15)14(2)3/h4-5H,6H2,1-3H3,(H,12,13)
InChIKeyMHMZOMBQZBNGIE-UHFFFAOYSA-N
MW272.15 g/mol
LogP1.65
Rot. Bonds3

About 2-[(5-bromo-4-methyl-2-pyridinyl)amino]-N,N-dimethylacetamide

2-[(5-bromo-4-methyl-2-pyridinyl)amino]-N,N-dimethylacetamide (PubChem CID 115773852) has the molecular formula C10H14BrN3O and a molecular weight of 272.15 g/mol. Its IUPAC name is 2-[(5-bromo-4-methyl-2-pyridinyl)amino]-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-[(5-bromo-4-methyl-2-pyridinyl)amino]-N,N-dimethylacetamide
PubChem CID115773852
Molecular FormulaC10H14BrN3O
Molecular Weight272.15 g/mol
Exact Mass271.03
IUPAC Name2-[(5-bromo-4-methyl-2-pyridinyl)amino]-N,N-dimethylacetamide
SMILESCc1cc(NCC(=O)N(C)C)ncc1Br
InChIInChI=1S/C10H14BrN3O/c1-7-4-9(12-5-8(7)11)13-6-10(15)14(2)3/h4-5H,6H2,1-3H3,(H,12,13)
InChIKeyMHMZOMBQZBNGIE-UHFFFAOYSA-N
XLogP1.65
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.15
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-4-methyl-N-(2-methylidenebutyl)pyridin-2-amine
CID 130655433
2-bromo-N-(5-bromo-4-methyl-2-pyridinyl)acetamide
CID 79734217
3-[(5-bromo-4-methyl-2-pyridinyl)amino]propan-1-ol
CID 53409461
3-[(5-bromo-4-methyl-2-pyridinyl)amino]-N-tert-butylpropanamide
CID 115774058
2-[(5-tert-butyl-2-pyridinyl)amino]-N,N-dimethylacetamide
CID 114011543
3-[(5-bromo-4-methyl-2-pyridinyl)amino]-N-propan-2-ylpropanamide
CID 113340036
3-[(5-bromo-4-methyl-2-pyridinyl)amino]propane-1,2-diol
CID 86802622
1-[(5-bromo-4-methyl-2-pyridinyl)amino]butan-2-ol
CID 114869387
N-(5-bromo-4-methyl-2-pyridinyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112602862
3-[(5-bromo-4-methyl-2-pyridinyl)amino]-N-(2-methylpropyl)propanamide
CID 114869367
5-bromo-4-methyl-N-pentylpyridin-2-amine
CID 70003079
2-[(5-bromo-4-methyl-2-pyridinyl)amino]-4-methylpentanoic acid
CID 122062511

Frequently Asked Questions

What is the IUPAC name of 2-[(5-bromo-4-methyl-2-pyridinyl)amino]-N,N-dimethylacetamide?
The IUPAC name of 2-[(5-bromo-4-methyl-2-pyridinyl)amino]-N,N-dimethylacetamide (CID 115773852) is 2-[(5-bromo-4-methyl-2-pyridinyl)amino]-N,N-dimethylacetamide.
What is the SMILES notation for 2-[(5-bromo-4-methyl-2-pyridinyl)amino]-N,N-dimethylacetamide?
The canonical SMILES for 2-[(5-bromo-4-methyl-2-pyridinyl)amino]-N,N-dimethylacetamide is Cc1cc(NCC(=O)N(C)C)ncc1Br.
What is the InChIKey of 2-[(5-bromo-4-methyl-2-pyridinyl)amino]-N,N-dimethylacetamide?
The InChIKey is MHMZOMBQZBNGIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14BrN3O/c1-7-4-9(12-5-8(7)11)13-6-10(15)14(2)3/h4-5H,6H2,1-3H3,(H,12,13).
What are the key properties of 2-[(5-bromo-4-methyl-2-pyridinyl)amino]-N,N-dimethylacetamide?
2-[(5-bromo-4-methyl-2-pyridinyl)amino]-N,N-dimethylacetamide has a molecular weight of 272.15 g/mol, XLogP of 1.65, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-bromo-4-methyl-2-pyridinyl)amino]-N,N-dimethylacetamide is sourced from PubChem (CID 115773852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).