2-(4-aminopiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide

C13H20N4O — CID 79333901

IUPAC2-(4-aminopiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide
SMILESNC1CCN(CC(=O)NCc2ccccn2)CC1
InChIInChI=1S/C13H20N4O/c14-11-4-7-17(8-5-11)10-13(18)16-9-12-3-1-2-6-15-12/h1-3,6,11H,4-5,7-10,14H2,(H,16,18)
InChIKeyGVVSXFGLDIAXKY-UHFFFAOYSA-N
MW248.33 g/mol
LogP0.12
Rot. Bonds4

About 2-(4-aminopiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide

2-(4-aminopiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide (PubChem CID 79333901) has the molecular formula C13H20N4O and a molecular weight of 248.33 g/mol. Its IUPAC name is 2-(4-aminopiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(4-aminopiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide
PubChem CID79333901
Molecular FormulaC13H20N4O
Molecular Weight248.33 g/mol
Exact Mass248.16
IUPAC Name2-(4-aminopiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide
SMILESNC1CCN(CC(=O)NCc2ccccn2)CC1
InChIInChI=1S/C13H20N4O/c14-11-4-7-17(8-5-11)10-13(18)16-9-12-3-1-2-6-15-12/h1-3,6,11H,4-5,7-10,14H2,(H,16,18)
InChIKeyGVVSXFGLDIAXKY-UHFFFAOYSA-N
XLogP0.12
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 50.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-benzylpiperazin-1-yl)-N-(pyridin-2-ylmethyl)acetamide
CID 46488455
2-(4-aminopiperidin-1-yl)-N-(1,3-thiazol-4-ylmethyl)acetamide
CID 79328654
2-(3-methylpiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide
CID 108999232
2-[4-(cyclopropylmethyl)-2,3-dihydroquinoxalin-1-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 71985240
2-[(2R)-2-phenylthiomorpholin-4-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 97214559
2-[(3R,4R)-3-hydroxy-3,4-dimethylpyrrolidin-1-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 72894294
2-[4-[(2R)-2-hydroxy-3,3-dimethylbutyl]piperazin-1-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 95311404
2-(6-hydroxy-4-propyl-1,4-diazepan-1-yl)-N-(pyridin-2-ylmethyl)acetamide
CID 74242130
2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 46056291
2-(4-aminopiperidin-1-yl)-N-(thiophen-3-ylmethyl)acetamide
CID 79328116
2-[(3R)-3-[[(2R)-2-methylpiperidin-1-yl]methyl]piperidin-1-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 95626413
2-[(3R)-3-[methyl-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]amino]pyrrolidin-1-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 96512054

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminopiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide?
The IUPAC name of 2-(4-aminopiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide (CID 79333901) is 2-(4-aminopiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide.
What is the SMILES notation for 2-(4-aminopiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide?
The canonical SMILES for 2-(4-aminopiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide is NC1CCN(CC(=O)NCc2ccccn2)CC1.
What is the InChIKey of 2-(4-aminopiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide?
The InChIKey is GVVSXFGLDIAXKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O/c14-11-4-7-17(8-5-11)10-13(18)16-9-12-3-1-2-6-15-12/h1-3,6,11H,4-5,7-10,14H2,(H,16,18).
What are the key properties of 2-(4-aminopiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide?
2-(4-aminopiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide has a molecular weight of 248.33 g/mol, XLogP of 0.12, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminopiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide is sourced from PubChem (CID 79333901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).