2-(5-amino-2-pyridinyl)-N-(1-hydroxypentan-3-yl)acetamide

C12H19N3O2 — CID 107339685

IUPAC2-(5-amino-2-pyridinyl)-N-(1-hydroxypentan-3-yl)acetamide
SMILESCCC(CCO)NC(=O)Cc1ccc(N)cn1
InChIInChI=1S/C12H19N3O2/c1-2-10(5-6-16)15-12(17)7-11-4-3-9(13)8-14-11/h3-4,8,10,16H,2,5-7,13H2,1H3,(H,15,17)
InChIKeyAFWWXKOFGIZCGR-UHFFFAOYSA-N
MW237.30 g/mol
LogP0.48
Rot. Bonds6

About 2-(5-amino-2-pyridinyl)-N-(1-hydroxypentan-3-yl)acetamide

2-(5-amino-2-pyridinyl)-N-(1-hydroxypentan-3-yl)acetamide (PubChem CID 107339685) has the molecular formula C12H19N3O2 and a molecular weight of 237.30 g/mol. Its IUPAC name is 2-(5-amino-2-pyridinyl)-N-(1-hydroxypentan-3-yl)acetamide.

Molecular Properties

Compound Name2-(5-amino-2-pyridinyl)-N-(1-hydroxypentan-3-yl)acetamide
PubChem CID107339685
Molecular FormulaC12H19N3O2
Molecular Weight237.30 g/mol
Exact Mass237.15
IUPAC Name2-(5-amino-2-pyridinyl)-N-(1-hydroxypentan-3-yl)acetamide
SMILESCCC(CCO)NC(=O)Cc1ccc(N)cn1
InChIInChI=1S/C12H19N3O2/c1-2-10(5-6-16)15-12(17)7-11-4-3-9(13)8-14-11/h3-4,8,10,16H,2,5-7,13H2,1H3,(H,15,17)
InChIKeyAFWWXKOFGIZCGR-UHFFFAOYSA-N
XLogP0.48
TPSA88.24 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 50.48
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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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
(2S)-2-[[2-(5-amino-2-pyridinyl)acetyl]amino]propanoic acid
CID 107338226
2-(5-amino-2-pyridinyl)-N-(2-ethylhexyl)acetamide
CID 107338276
2-(5-amino-2-pyridinyl)-N-(2-methylbutyl)acetamide
CID 107338689
(2R)-2-[[2-(5-amino-2-pyridinyl)acetyl]amino]-3-methylbutanoic acid
CID 107339052
(2S)-2-[[2-(5-amino-2-pyridinyl)acetyl]amino]-3,3-dimethylbutanoic acid
CID 107338218
2-(5-amino-2-pyridinyl)-N-[(1S)-1-phenylethyl]acetamide
CID 107338863
2-(5-amino-2-pyridinyl)-N-[1-(2-methylphenyl)ethyl]acetamide
CID 107338393
2-(5-amino-2-pyridinyl)-N-(1-cyanopropan-2-yl)acetamide
CID 107338629
2-(5-amino-2-pyridinyl)-N-[1-(4-propan-2-ylphenyl)ethyl]acetamide;hydrochloride
CID 120617873
methyl 3-[[2-(5-amino-2-pyridinyl)acetyl]amino]butanoate
CID 120618929

Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-2-pyridinyl)-N-(1-hydroxypentan-3-yl)acetamide?
The IUPAC name of 2-(5-amino-2-pyridinyl)-N-(1-hydroxypentan-3-yl)acetamide (CID 107339685) is 2-(5-amino-2-pyridinyl)-N-(1-hydroxypentan-3-yl)acetamide.
What is the SMILES notation for 2-(5-amino-2-pyridinyl)-N-(1-hydroxypentan-3-yl)acetamide?
The canonical SMILES for 2-(5-amino-2-pyridinyl)-N-(1-hydroxypentan-3-yl)acetamide is CCC(CCO)NC(=O)Cc1ccc(N)cn1.
What is the InChIKey of 2-(5-amino-2-pyridinyl)-N-(1-hydroxypentan-3-yl)acetamide?
The InChIKey is AFWWXKOFGIZCGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2/c1-2-10(5-6-16)15-12(17)7-11-4-3-9(13)8-14-11/h3-4,8,10,16H,2,5-7,13H2,1H3,(H,15,17).
What are the key properties of 2-(5-amino-2-pyridinyl)-N-(1-hydroxypentan-3-yl)acetamide?
2-(5-amino-2-pyridinyl)-N-(1-hydroxypentan-3-yl)acetamide has a molecular weight of 237.30 g/mol, XLogP of 0.48, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-2-pyridinyl)-N-(1-hydroxypentan-3-yl)acetamide is sourced from PubChem (CID 107339685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).