2-(5-amino-2-pyridinyl)-N-(2-methylbutyl)acetamide

C12H19N3O — CID 107338689

IUPAC2-(5-amino-2-pyridinyl)-N-(2-methylbutyl)acetamide
SMILESCCC(C)CNC(=O)Cc1ccc(N)cn1
InChIInChI=1S/C12H19N3O/c1-3-9(2)7-15-12(16)6-11-5-4-10(13)8-14-11/h4-5,8-9H,3,6-7,13H2,1-2H3,(H,15,16)
InChIKeyVDKGBCKTQNLRPH-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.37
Rot. Bonds5

About 2-(5-amino-2-pyridinyl)-N-(2-methylbutyl)acetamide

2-(5-amino-2-pyridinyl)-N-(2-methylbutyl)acetamide (PubChem CID 107338689) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is 2-(5-amino-2-pyridinyl)-N-(2-methylbutyl)acetamide.

Molecular Properties

Compound Name2-(5-amino-2-pyridinyl)-N-(2-methylbutyl)acetamide
PubChem CID107338689
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name2-(5-amino-2-pyridinyl)-N-(2-methylbutyl)acetamide
SMILESCCC(C)CNC(=O)Cc1ccc(N)cn1
InChIInChI=1S/C12H19N3O/c1-3-9(2)7-15-12(16)6-11-5-4-10(13)8-14-11/h4-5,8-9H,3,6-7,13H2,1-2H3,(H,15,16)
InChIKeyVDKGBCKTQNLRPH-UHFFFAOYSA-N
XLogP1.37
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-[[2-(5-amino-2-pyridinyl)acetyl]amino]-4-methylpentanoic acid
CID 107339460
2-(5-amino-2-pyridinyl)-N-(2-cyanopropyl)acetamide
CID 107338684
2-(5-amino-2-pyridinyl)-N-(2-ethylhexyl)acetamide
CID 107338276
2-(5-amino-2-pyridinyl)-N-(2,2-difluoroethyl)acetamide;hydrochloride
CID 120632231
2-(5-amino-2-pyridinyl)-N-butan-2-ylacetamide
CID 107337332
2-(5-amino-2-pyridinyl)-N-(3-methyl-2-pyrrolidin-1-ylbutyl)acetamide
CID 107338304
2-(5-amino-2-pyridinyl)-N-octylacetamide
CID 107339440
2-(5-amino-2-pyridinyl)-N-(2-hydroxy-2-methylpropyl)acetamide
CID 107339002
(2S)-2-[[2-(5-amino-2-pyridinyl)acetyl]amino]propanoic acid
CID 107338226
2-(5-amino-2-pyridinyl)-N-(2-methoxyethyl)acetamide
CID 107337331
2-(5-amino-2-pyridinyl)-N-[2-(2-methylpropoxy)ethyl]acetamide
CID 107339726
2-(5-amino-2-pyridinyl)-N-(1-hydroxypentan-3-yl)acetamide
CID 107339685

Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-2-pyridinyl)-N-(2-methylbutyl)acetamide?
The IUPAC name of 2-(5-amino-2-pyridinyl)-N-(2-methylbutyl)acetamide (CID 107338689) is 2-(5-amino-2-pyridinyl)-N-(2-methylbutyl)acetamide.
What is the SMILES notation for 2-(5-amino-2-pyridinyl)-N-(2-methylbutyl)acetamide?
The canonical SMILES for 2-(5-amino-2-pyridinyl)-N-(2-methylbutyl)acetamide is CCC(C)CNC(=O)Cc1ccc(N)cn1.
What is the InChIKey of 2-(5-amino-2-pyridinyl)-N-(2-methylbutyl)acetamide?
The InChIKey is VDKGBCKTQNLRPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-3-9(2)7-15-12(16)6-11-5-4-10(13)8-14-11/h4-5,8-9H,3,6-7,13H2,1-2H3,(H,15,16).
What are the key properties of 2-(5-amino-2-pyridinyl)-N-(2-methylbutyl)acetamide?
2-(5-amino-2-pyridinyl)-N-(2-methylbutyl)acetamide has a molecular weight of 221.30 g/mol, XLogP of 1.37, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-2-pyridinyl)-N-(2-methylbutyl)acetamide is sourced from PubChem (CID 107338689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).