2-piperidin-2-yl-N-(2-pyridin-3-ylethyl)acetamide

C14H21N3O — CID 115160524

IUPAC2-piperidin-2-yl-N-(2-pyridin-3-ylethyl)acetamide
SMILESO=C(CC1CCCCN1)NCCc1cccnc1
InChIInChI=1S/C14H21N3O/c18-14(10-13-5-1-2-8-16-13)17-9-6-12-4-3-7-15-11-12/h3-4,7,11,13,16H,1-2,5-6,8-10H2,(H,17,18)
InChIKeyFXGCLSONUOFNIB-UHFFFAOYSA-N
MW247.34 g/mol
LogP1.27
Rot. Bonds5

About 2-piperidin-2-yl-N-(2-pyridin-3-ylethyl)acetamide

2-piperidin-2-yl-N-(2-pyridin-3-ylethyl)acetamide (PubChem CID 115160524) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is 2-piperidin-2-yl-N-(2-pyridin-3-ylethyl)acetamide.

Molecular Properties

Compound Name2-piperidin-2-yl-N-(2-pyridin-3-ylethyl)acetamide
PubChem CID115160524
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC Name2-piperidin-2-yl-N-(2-pyridin-3-ylethyl)acetamide
SMILESO=C(CC1CCCCN1)NCCc1cccnc1
InChIInChI=1S/C14H21N3O/c18-14(10-13-5-1-2-8-16-13)17-9-6-12-4-3-7-15-11-12/h3-4,7,11,13,16H,1-2,5-6,8-10H2,(H,17,18)
InChIKeyFXGCLSONUOFNIB-UHFFFAOYSA-N
XLogP1.27
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-piperidin-2-yl-N-(2-pyridin-3-ylethyl)acetamide?
The IUPAC name of 2-piperidin-2-yl-N-(2-pyridin-3-ylethyl)acetamide (CID 115160524) is 2-piperidin-2-yl-N-(2-pyridin-3-ylethyl)acetamide.
What is the SMILES notation for 2-piperidin-2-yl-N-(2-pyridin-3-ylethyl)acetamide?
The canonical SMILES for 2-piperidin-2-yl-N-(2-pyridin-3-ylethyl)acetamide is O=C(CC1CCCCN1)NCCc1cccnc1.
What is the InChIKey of 2-piperidin-2-yl-N-(2-pyridin-3-ylethyl)acetamide?
The InChIKey is FXGCLSONUOFNIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c18-14(10-13-5-1-2-8-16-13)17-9-6-12-4-3-7-15-11-12/h3-4,7,11,13,16H,1-2,5-6,8-10H2,(H,17,18).
What are the key properties of 2-piperidin-2-yl-N-(2-pyridin-3-ylethyl)acetamide?
2-piperidin-2-yl-N-(2-pyridin-3-ylethyl)acetamide has a molecular weight of 247.34 g/mol, XLogP of 1.27, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperidin-2-yl-N-(2-pyridin-3-ylethyl)acetamide is sourced from PubChem (CID 115160524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).