4-hydroxy-N-(pyridin-4-ylmethyl)butanamide

C10H14N2O2 — CID 79002356

IUPAC4-hydroxy-N-(pyridin-4-ylmethyl)butanamide
SMILESO=C(CCCO)NCc1ccncc1
InChIInChI=1S/C10H14N2O2/c13-7-1-2-10(14)12-8-9-3-5-11-6-4-9/h3-6,13H,1-2,7-8H2,(H,12,14)
InChIKeyJXNRVOOWLGVWNL-UHFFFAOYSA-N
MW194.23 g/mol
LogP0.47
Rot. Bonds5

About 4-hydroxy-N-(pyridin-4-ylmethyl)butanamide

4-hydroxy-N-(pyridin-4-ylmethyl)butanamide (PubChem CID 79002356) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is 4-hydroxy-N-(pyridin-4-ylmethyl)butanamide.

Molecular Properties

Compound Name4-hydroxy-N-(pyridin-4-ylmethyl)butanamide
PubChem CID79002356
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name4-hydroxy-N-(pyridin-4-ylmethyl)butanamide
SMILESO=C(CCCO)NCc1ccncc1
InChIInChI=1S/C10H14N2O2/c13-7-1-2-10(14)12-8-9-3-5-11-6-4-9/h3-6,13H,1-2,7-8H2,(H,12,14)
InChIKeyJXNRVOOWLGVWNL-UHFFFAOYSA-N
XLogP0.47
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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2-iodo-N-(pyridin-4-ylmethyl)acetamide
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4,4,4-trifluoro-N-(pyridin-4-ylmethyl)butanamide
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(2S)-2-amino-6-oxo-6-(pyridin-4-ylmethylamino)hexanoic acid
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3-cyano-N-(pyridin-4-ylmethyl)propanamide
CID 82111754
3-(butylamino)-N-(pyridin-4-ylmethyl)propanamide
CID 109012394
N-[(4-fluorophenyl)methyl]-5-hydroxypentanamide
CID 79199621
N-(6-hydroxyhexyl)-3-pyridin-4-ylpropanamide
CID 113351816
3-(tert-butylamino)-N-(pyridin-4-ylmethyl)propanamide
CID 60849701
3-(4-aminophenyl)-N-(pyridin-4-ylmethyl)propanamide
CID 28712872
11-[[2-(decanoylamino)acetyl]amino]-N-(pyridin-4-ylmethyl)undecanamide
CID 71069950

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-(pyridin-4-ylmethyl)butanamide?
The IUPAC name of 4-hydroxy-N-(pyridin-4-ylmethyl)butanamide (CID 79002356) is 4-hydroxy-N-(pyridin-4-ylmethyl)butanamide.
What is the SMILES notation for 4-hydroxy-N-(pyridin-4-ylmethyl)butanamide?
The canonical SMILES for 4-hydroxy-N-(pyridin-4-ylmethyl)butanamide is O=C(CCCO)NCc1ccncc1.
What is the InChIKey of 4-hydroxy-N-(pyridin-4-ylmethyl)butanamide?
The InChIKey is JXNRVOOWLGVWNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c13-7-1-2-10(14)12-8-9-3-5-11-6-4-9/h3-6,13H,1-2,7-8H2,(H,12,14).
What are the key properties of 4-hydroxy-N-(pyridin-4-ylmethyl)butanamide?
4-hydroxy-N-(pyridin-4-ylmethyl)butanamide has a molecular weight of 194.23 g/mol, XLogP of 0.47, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-(pyridin-4-ylmethyl)butanamide is sourced from PubChem (CID 79002356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).