3-amino-N-(5-bromo-4-methyl-2-pyridinyl)-2-methylpropanamide

C10H14BrN3O — CID 79734420

IUPAC3-amino-N-(5-bromo-4-methyl-2-pyridinyl)-2-methylpropanamide
SMILESCc1cc(NC(=O)C(C)CN)ncc1Br
InChIInChI=1S/C10H14BrN3O/c1-6-3-9(13-5-8(6)11)14-10(15)7(2)4-12/h3,5,7H,4,12H2,1-2H3,(H,13,14,15)
InChIKeyGVGVRUCOANFLGP-UHFFFAOYSA-N
MW272.15 g/mol
LogP1.69
Rot. Bonds3

About 3-amino-N-(5-bromo-4-methyl-2-pyridinyl)-2-methylpropanamide

3-amino-N-(5-bromo-4-methyl-2-pyridinyl)-2-methylpropanamide (PubChem CID 79734420) has the molecular formula C10H14BrN3O and a molecular weight of 272.15 g/mol. Its IUPAC name is 3-amino-N-(5-bromo-4-methyl-2-pyridinyl)-2-methylpropanamide.

Molecular Properties

Compound Name3-amino-N-(5-bromo-4-methyl-2-pyridinyl)-2-methylpropanamide
PubChem CID79734420
Molecular FormulaC10H14BrN3O
Molecular Weight272.15 g/mol
Exact Mass271.03
IUPAC Name3-amino-N-(5-bromo-4-methyl-2-pyridinyl)-2-methylpropanamide
SMILESCc1cc(NC(=O)C(C)CN)ncc1Br
InChIInChI=1S/C10H14BrN3O/c1-6-3-9(13-5-8(6)11)14-10(15)7(2)4-12/h3,5,7H,4,12H2,1-2H3,(H,13,14,15)
InChIKeyGVGVRUCOANFLGP-UHFFFAOYSA-N
XLogP1.69
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.15
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-bromo-4-methyl-2-pyridinyl)-2-methylpentanamide
CID 79734521
5-amino-N-(5-bromo-4-methyl-2-pyridinyl)-2-methylpentanamide
CID 104685319
N-(5-bromo-4-methyl-2-pyridinyl)-2-methyl-3-methylsulfanylpropanamide
CID 75494689
(2S)-2-amino-N-(5-bromo-4-methyl-2-pyridinyl)propanamide
CID 79734122
3-amino-N-(5-bromo-4-methyl-2-pyridinyl)-2-phenylpropanamide
CID 79733322
N-(5-bromo-4-methyl-2-pyridinyl)-2-methylsulfonylpropanamide
CID 112697409
2-bromo-N-(5-bromo-4-methyl-2-pyridinyl)acetamide
CID 79734217
4-(2-aminoethyl)-N-(5-bromo-4-methyl-2-pyridinyl)-5-methylhexanamide
CID 79734817
2-amino-N-(5-bromo-4-methyl-2-pyridinyl)-4-methoxybutanamide
CID 79734820
N-(5-bromo-4-methyl-2-pyridinyl)-3-(propan-2-ylamino)propanamide
CID 79734413
2-N-(5-bromo-4-methyl-2-pyridinyl)-3-methylbutane-1,2-diamine
CID 114869550
5-bromo-4-methylpyridin-2-amine;N-(5-bromo-4-methyl-2-pyridinyl)acetamide
CID 162076548

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(5-bromo-4-methyl-2-pyridinyl)-2-methylpropanamide?
The IUPAC name of 3-amino-N-(5-bromo-4-methyl-2-pyridinyl)-2-methylpropanamide (CID 79734420) is 3-amino-N-(5-bromo-4-methyl-2-pyridinyl)-2-methylpropanamide.
What is the SMILES notation for 3-amino-N-(5-bromo-4-methyl-2-pyridinyl)-2-methylpropanamide?
The canonical SMILES for 3-amino-N-(5-bromo-4-methyl-2-pyridinyl)-2-methylpropanamide is Cc1cc(NC(=O)C(C)CN)ncc1Br.
What is the InChIKey of 3-amino-N-(5-bromo-4-methyl-2-pyridinyl)-2-methylpropanamide?
The InChIKey is GVGVRUCOANFLGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14BrN3O/c1-6-3-9(13-5-8(6)11)14-10(15)7(2)4-12/h3,5,7H,4,12H2,1-2H3,(H,13,14,15).
What are the key properties of 3-amino-N-(5-bromo-4-methyl-2-pyridinyl)-2-methylpropanamide?
3-amino-N-(5-bromo-4-methyl-2-pyridinyl)-2-methylpropanamide has a molecular weight of 272.15 g/mol, XLogP of 1.69, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(5-bromo-4-methyl-2-pyridinyl)-2-methylpropanamide is sourced from PubChem (CID 79734420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).