N-[(6-methyl-2-pyridinyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide

C14H19N3O2 — CID 86824300

IUPACN-[(6-methyl-2-pyridinyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide
SMILESCc1cccc(CNC(=O)CN2CCCCC2=O)n1
InChIInChI=1S/C14H19N3O2/c1-11-5-4-6-12(16-11)9-15-13(18)10-17-8-3-2-7-14(17)19/h4-6H,2-3,7-10H2,1H3,(H,15,18)
InChIKeyNKPDDGUXULRAHQ-UHFFFAOYSA-N
MW261.32 g/mol
LogP1.02
Rot. Bonds4

About N-[(6-methyl-2-pyridinyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide

N-[(6-methyl-2-pyridinyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide (PubChem CID 86824300) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is N-[(6-methyl-2-pyridinyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide.

Molecular Properties

Compound NameN-[(6-methyl-2-pyridinyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide
PubChem CID86824300
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC NameN-[(6-methyl-2-pyridinyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide
SMILESCc1cccc(CNC(=O)CN2CCCCC2=O)n1
InChIInChI=1S/C14H19N3O2/c1-11-5-4-6-12(16-11)9-15-13(18)10-17-8-3-2-7-14(17)19/h4-6H,2-3,7-10H2,1H3,(H,15,18)
InChIKeyNKPDDGUXULRAHQ-UHFFFAOYSA-N
XLogP1.02
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(6-methyl-2-pyridinyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide?
The IUPAC name of N-[(6-methyl-2-pyridinyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide (CID 86824300) is N-[(6-methyl-2-pyridinyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide.
What is the SMILES notation for N-[(6-methyl-2-pyridinyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide?
The canonical SMILES for N-[(6-methyl-2-pyridinyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide is Cc1cccc(CNC(=O)CN2CCCCC2=O)n1.
What is the InChIKey of N-[(6-methyl-2-pyridinyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide?
The InChIKey is NKPDDGUXULRAHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-11-5-4-6-12(16-11)9-15-13(18)10-17-8-3-2-7-14(17)19/h4-6H,2-3,7-10H2,1H3,(H,15,18).
What are the key properties of N-[(6-methyl-2-pyridinyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide?
N-[(6-methyl-2-pyridinyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide has a molecular weight of 261.32 g/mol, XLogP of 1.02, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-methyl-2-pyridinyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide is sourced from PubChem (CID 86824300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).