2-(2-oxo-1-pyridinyl)-N-(2-piperidin-3-ylethyl)acetamide;hydrochloride

C14H22ClN3O2 — CID 119557505

IUPAC2-(2-oxo-1-pyridinyl)-N-(2-piperidin-3-ylethyl)acetamide;hydrochloride
SMILESCl.O=C(Cn1ccccc1=O)NCCC1CCCNC1
InChIInChI=1S/C14H21N3O2.ClH/c18-13(11-17-9-2-1-5-14(17)19)16-8-6-12-4-3-7-15-10-12;/h1-2,5,9,12,15H,3-4,6-8,10-11H2,(H,16,18);1H
InChIKeyZMQFLXUEWZRYLL-UHFFFAOYSA-N
MW299.80 g/mol
LogP0.78
Rot. Bonds5

About 2-(2-oxo-1-pyridinyl)-N-(2-piperidin-3-ylethyl)acetamide;hydrochloride

2-(2-oxo-1-pyridinyl)-N-(2-piperidin-3-ylethyl)acetamide;hydrochloride (PubChem CID 119557505) has the molecular formula C14H22ClN3O2 and a molecular weight of 299.80 g/mol. Its IUPAC name is 2-(2-oxo-1-pyridinyl)-N-(2-piperidin-3-ylethyl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-(2-oxo-1-pyridinyl)-N-(2-piperidin-3-ylethyl)acetamide;hydrochloride
PubChem CID119557505
Molecular FormulaC14H22ClN3O2
Molecular Weight299.80 g/mol
Exact Mass299.14
IUPAC Name2-(2-oxo-1-pyridinyl)-N-(2-piperidin-3-ylethyl)acetamide;hydrochloride
SMILESCl.O=C(Cn1ccccc1=O)NCCC1CCCNC1
InChIInChI=1S/C14H21N3O2.ClH/c18-13(11-17-9-2-1-5-14(17)19)16-8-6-12-4-3-7-15-10-12;/h1-2,5,9,12,15H,3-4,6-8,10-11H2,(H,16,18);1H
InChIKeyZMQFLXUEWZRYLL-UHFFFAOYSA-N
XLogP0.78
TPSA63.13 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.80
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-oxo-1-pyridinyl)-N-(2-piperidin-3-ylethyl)acetamide;hydrochloride?
The IUPAC name of 2-(2-oxo-1-pyridinyl)-N-(2-piperidin-3-ylethyl)acetamide;hydrochloride (CID 119557505) is 2-(2-oxo-1-pyridinyl)-N-(2-piperidin-3-ylethyl)acetamide;hydrochloride.
What is the SMILES notation for 2-(2-oxo-1-pyridinyl)-N-(2-piperidin-3-ylethyl)acetamide;hydrochloride?
The canonical SMILES for 2-(2-oxo-1-pyridinyl)-N-(2-piperidin-3-ylethyl)acetamide;hydrochloride is Cl.O=C(Cn1ccccc1=O)NCCC1CCCNC1.
What is the InChIKey of 2-(2-oxo-1-pyridinyl)-N-(2-piperidin-3-ylethyl)acetamide;hydrochloride?
The InChIKey is ZMQFLXUEWZRYLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2.ClH/c18-13(11-17-9-2-1-5-14(17)19)16-8-6-12-4-3-7-15-10-12;/h1-2,5,9,12,15H,3-4,6-8,10-11H2,(H,16,18);1H.
What are the key properties of 2-(2-oxo-1-pyridinyl)-N-(2-piperidin-3-ylethyl)acetamide;hydrochloride?
2-(2-oxo-1-pyridinyl)-N-(2-piperidin-3-ylethyl)acetamide;hydrochloride has a molecular weight of 299.80 g/mol, XLogP of 0.78, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-oxo-1-pyridinyl)-N-(2-piperidin-3-ylethyl)acetamide;hydrochloride is sourced from PubChem (CID 119557505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).