2-(4-aminopiperidin-1-yl)-N-(2-hydroxyphenyl)acetamide

C13H19N3O2 — CID 79327429

IUPAC2-(4-aminopiperidin-1-yl)-N-(2-hydroxyphenyl)acetamide
SMILESNC1CCN(CC(=O)Nc2ccccc2O)CC1
InChIInChI=1S/C13H19N3O2/c14-10-5-7-16(8-6-10)9-13(18)15-11-3-1-2-4-12(11)17/h1-4,10,17H,5-9,14H2,(H,15,18)
InChIKeyYRVBYBBHPMQSKA-UHFFFAOYSA-N
MW249.31 g/mol
LogP0.75
Rot. Bonds3

About 2-(4-aminopiperidin-1-yl)-N-(2-hydroxyphenyl)acetamide

2-(4-aminopiperidin-1-yl)-N-(2-hydroxyphenyl)acetamide (PubChem CID 79327429) has the molecular formula C13H19N3O2 and a molecular weight of 249.31 g/mol. Its IUPAC name is 2-(4-aminopiperidin-1-yl)-N-(2-hydroxyphenyl)acetamide.

Molecular Properties

Compound Name2-(4-aminopiperidin-1-yl)-N-(2-hydroxyphenyl)acetamide
PubChem CID79327429
Molecular FormulaC13H19N3O2
Molecular Weight249.31 g/mol
Exact Mass249.15
IUPAC Name2-(4-aminopiperidin-1-yl)-N-(2-hydroxyphenyl)acetamide
SMILESNC1CCN(CC(=O)Nc2ccccc2O)CC1
InChIInChI=1S/C13H19N3O2/c14-10-5-7-16(8-6-10)9-13(18)15-11-3-1-2-4-12(11)17/h1-4,10,17H,5-9,14H2,(H,15,18)
InChIKeyYRVBYBBHPMQSKA-UHFFFAOYSA-N
XLogP0.75
TPSA78.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 50.75
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol', 'substructure': 'N/A'}

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Related Compounds

2-[(3R)-3-aminopyrrolidin-1-yl]-N-(2-fluorophenyl)acetamide;hydrochloride
CID 119905386
2-(3-aminopyrrolidin-1-yl)-N-(2-fluorophenyl)acetamide;hydrochloride
CID 119917633
2-(4-aminopiperidin-1-yl)-N-[2-(2-methoxyethyl)phenyl]acetamide
CID 102905623
2-(4-aminopiperidin-1-yl)-N-(3-hydroxy-2,4-dimethylphenyl)acetamide
CID 79327471
2-[[2-[4-(hydroxymethyl)piperidin-1-yl]acetyl]amino]benzamide
CID 60968756
2-[4-(aminomethyl)piperidin-1-yl]-N-(2-iodophenyl)acetamide;hydrochloride
CID 119909750
3-(4-aminopiperidin-1-yl)-N-(2-chlorophenyl)propanamide
CID 43556671
2-(4-aminopiperidin-1-yl)-N-(3-fluoro-4-hydroxyphenyl)acetamide
CID 79327970
2-[4-(methylamino)piperidin-1-yl]-N-(2-methylphenyl)acetamide
CID 60818956
4-[[2-(4-aminopiperidin-1-yl)acetyl]amino]-3-methylbenzamide
CID 79322701
2-(4-aminopiperidin-1-yl)-N-(1-phenylethyl)acetamide
CID 43556855
N-(2-fluorophenyl)-2-[4-(methylamino)piperidin-1-yl]acetamide
CID 54923773

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminopiperidin-1-yl)-N-(2-hydroxyphenyl)acetamide?
The IUPAC name of 2-(4-aminopiperidin-1-yl)-N-(2-hydroxyphenyl)acetamide (CID 79327429) is 2-(4-aminopiperidin-1-yl)-N-(2-hydroxyphenyl)acetamide.
What is the SMILES notation for 2-(4-aminopiperidin-1-yl)-N-(2-hydroxyphenyl)acetamide?
The canonical SMILES for 2-(4-aminopiperidin-1-yl)-N-(2-hydroxyphenyl)acetamide is NC1CCN(CC(=O)Nc2ccccc2O)CC1.
What is the InChIKey of 2-(4-aminopiperidin-1-yl)-N-(2-hydroxyphenyl)acetamide?
The InChIKey is YRVBYBBHPMQSKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O2/c14-10-5-7-16(8-6-10)9-13(18)15-11-3-1-2-4-12(11)17/h1-4,10,17H,5-9,14H2,(H,15,18).
What are the key properties of 2-(4-aminopiperidin-1-yl)-N-(2-hydroxyphenyl)acetamide?
2-(4-aminopiperidin-1-yl)-N-(2-hydroxyphenyl)acetamide has a molecular weight of 249.31 g/mol, XLogP of 0.75, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminopiperidin-1-yl)-N-(2-hydroxyphenyl)acetamide is sourced from PubChem (CID 79327429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).