2-amino-N-methyl-N-(6-methyl-3-pyridinyl)acetamide

C9H13N3O — CID 134406408

IUPAC2-amino-N-methyl-N-(6-methyl-3-pyridinyl)acetamide
SMILESCc1ccc(N(C)C(=O)CN)cn1
InChIInChI=1S/C9H13N3O/c1-7-3-4-8(6-11-7)12(2)9(13)5-10/h3-4,6H,5,10H2,1-2H3
InChIKeyJETKZHCSVHUYKY-UHFFFAOYSA-N
MW179.22 g/mol
LogP0.31
Rot. Bonds2

About 2-amino-N-methyl-N-(6-methyl-3-pyridinyl)acetamide

2-amino-N-methyl-N-(6-methyl-3-pyridinyl)acetamide (PubChem CID 134406408) has the molecular formula C9H13N3O and a molecular weight of 179.22 g/mol. Its IUPAC name is 2-amino-N-methyl-N-(6-methyl-3-pyridinyl)acetamide.

Molecular Properties

Compound Name2-amino-N-methyl-N-(6-methyl-3-pyridinyl)acetamide
PubChem CID134406408
Molecular FormulaC9H13N3O
Molecular Weight179.22 g/mol
Exact Mass179.11
IUPAC Name2-amino-N-methyl-N-(6-methyl-3-pyridinyl)acetamide
SMILESCc1ccc(N(C)C(=O)CN)cn1
InChIInChI=1S/C9H13N3O/c1-7-3-4-8(6-11-7)12(2)9(13)5-10/h3-4,6H,5,10H2,1-2H3
InChIKeyJETKZHCSVHUYKY-UHFFFAOYSA-N
XLogP0.31
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 50.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-methyl-N-(6-methyl-3-pyridinyl)acetamide?
The IUPAC name of 2-amino-N-methyl-N-(6-methyl-3-pyridinyl)acetamide (CID 134406408) is 2-amino-N-methyl-N-(6-methyl-3-pyridinyl)acetamide.
What is the SMILES notation for 2-amino-N-methyl-N-(6-methyl-3-pyridinyl)acetamide?
The canonical SMILES for 2-amino-N-methyl-N-(6-methyl-3-pyridinyl)acetamide is Cc1ccc(N(C)C(=O)CN)cn1.
What is the InChIKey of 2-amino-N-methyl-N-(6-methyl-3-pyridinyl)acetamide?
The InChIKey is JETKZHCSVHUYKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O/c1-7-3-4-8(6-11-7)12(2)9(13)5-10/h3-4,6H,5,10H2,1-2H3.
What are the key properties of 2-amino-N-methyl-N-(6-methyl-3-pyridinyl)acetamide?
2-amino-N-methyl-N-(6-methyl-3-pyridinyl)acetamide has a molecular weight of 179.22 g/mol, XLogP of 0.31, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-methyl-N-(6-methyl-3-pyridinyl)acetamide is sourced from PubChem (CID 134406408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).