2-(5-amino-2-pyridinyl)-N-(1-cyanopropan-2-yl)acetamide

C11H14N4O — CID 107338629

IUPAC2-(5-amino-2-pyridinyl)-N-(1-cyanopropan-2-yl)acetamide
SMILESCC(CC#N)NC(=O)Cc1ccc(N)cn1
InChIInChI=1S/C11H14N4O/c1-8(4-5-12)15-11(16)6-10-3-2-9(13)7-14-10/h2-3,7-8H,4,6,13H2,1H3,(H,15,16)
InChIKeyGKOLLSGAKKBPOT-UHFFFAOYSA-N
MW218.26 g/mol
LogP0.62
Rot. Bonds4

About 2-(5-amino-2-pyridinyl)-N-(1-cyanopropan-2-yl)acetamide

2-(5-amino-2-pyridinyl)-N-(1-cyanopropan-2-yl)acetamide (PubChem CID 107338629) has the molecular formula C11H14N4O and a molecular weight of 218.26 g/mol. Its IUPAC name is 2-(5-amino-2-pyridinyl)-N-(1-cyanopropan-2-yl)acetamide.

Molecular Properties

Compound Name2-(5-amino-2-pyridinyl)-N-(1-cyanopropan-2-yl)acetamide
PubChem CID107338629
Molecular FormulaC11H14N4O
Molecular Weight218.26 g/mol
Exact Mass218.12
IUPAC Name2-(5-amino-2-pyridinyl)-N-(1-cyanopropan-2-yl)acetamide
SMILESCC(CC#N)NC(=O)Cc1ccc(N)cn1
InChIInChI=1S/C11H14N4O/c1-8(4-5-12)15-11(16)6-10-3-2-9(13)7-14-10/h2-3,7-8H,4,6,13H2,1H3,(H,15,16)
InChIKeyGKOLLSGAKKBPOT-UHFFFAOYSA-N
XLogP0.62
TPSA91.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(5-amino-2-pyridinyl)-N-(1-cyanopropan-2-yl)acetamide 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

2-(5-amino-2-pyridinyl)-N-butan-2-ylacetamide
CID 107337332
2-(5-amino-2-pyridinyl)-N-(5-hydroxypentan-2-yl)acetamide
CID 107339254
methyl 3-[[2-(5-amino-2-pyridinyl)acetyl]amino]butanoate
CID 120618929
(2S)-2-[[2-(5-amino-2-pyridinyl)acetyl]amino]propanoic acid
CID 107338226
2-(5-amino-2-pyridinyl)-N-(2-cyanopropyl)acetamide
CID 107338684
(2R)-2-[[2-(5-amino-2-pyridinyl)acetyl]amino]-3-methylbutanoic acid
CID 107339052
2-(5-amino-2-pyridinyl)-N-[(1S)-1-phenylethyl]acetamide
CID 107338863
2-(5-amino-2-pyridinyl)-N-[1-(4-propan-2-ylphenyl)ethyl]acetamide;hydrochloride
CID 120617873
(2S)-2-[[2-(5-amino-2-pyridinyl)acetyl]amino]-3,3-dimethylbutanoic acid
CID 107338218
2-(5-amino-2-pyridinyl)-N-[1-(4-tert-butylphenyl)ethyl]acetamide
CID 120621513
2-(5-amino-2-pyridinyl)-N-[1-(2-methylphenyl)ethyl]acetamide
CID 107338393
N-(1-cyanopropan-2-yl)-2-phenylacetamide
CID 55211217

Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-2-pyridinyl)-N-(1-cyanopropan-2-yl)acetamide?
The IUPAC name of 2-(5-amino-2-pyridinyl)-N-(1-cyanopropan-2-yl)acetamide (CID 107338629) is 2-(5-amino-2-pyridinyl)-N-(1-cyanopropan-2-yl)acetamide.
What is the SMILES notation for 2-(5-amino-2-pyridinyl)-N-(1-cyanopropan-2-yl)acetamide?
The canonical SMILES for 2-(5-amino-2-pyridinyl)-N-(1-cyanopropan-2-yl)acetamide is CC(CC#N)NC(=O)Cc1ccc(N)cn1.
What is the InChIKey of 2-(5-amino-2-pyridinyl)-N-(1-cyanopropan-2-yl)acetamide?
The InChIKey is GKOLLSGAKKBPOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O/c1-8(4-5-12)15-11(16)6-10-3-2-9(13)7-14-10/h2-3,7-8H,4,6,13H2,1H3,(H,15,16).
What are the key properties of 2-(5-amino-2-pyridinyl)-N-(1-cyanopropan-2-yl)acetamide?
2-(5-amino-2-pyridinyl)-N-(1-cyanopropan-2-yl)acetamide has a molecular weight of 218.26 g/mol, XLogP of 0.62, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-2-pyridinyl)-N-(1-cyanopropan-2-yl)acetamide is sourced from PubChem (CID 107338629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).