2-(2-bicyclo[2.2.1]heptanyl)-N-(6-methoxy-3-pyridinyl)acetamide

C15H20N2O2 — CID 4878967

IUPAC2-(2-bicyclo[2.2.1]heptanyl)-N-(6-methoxy-3-pyridinyl)acetamide
SMILESCOc1ccc(NC(=O)CC2CC3CCC2C3)cn1
InChIInChI=1S/C15H20N2O2/c1-19-15-5-4-13(9-16-15)17-14(18)8-12-7-10-2-3-11(12)6-10/h4-5,9-12H,2-3,6-8H2,1H3,(H,17,18)
InChIKeyDQZUARKTEXWGKX-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.86
Rot. Bonds4

About 2-(2-bicyclo[2.2.1]heptanyl)-N-(6-methoxy-3-pyridinyl)acetamide

2-(2-bicyclo[2.2.1]heptanyl)-N-(6-methoxy-3-pyridinyl)acetamide (PubChem CID 4878967) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 2-(2-bicyclo[2.2.1]heptanyl)-N-(6-methoxy-3-pyridinyl)acetamide.

Molecular Properties

Compound Name2-(2-bicyclo[2.2.1]heptanyl)-N-(6-methoxy-3-pyridinyl)acetamide
PubChem CID4878967
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name2-(2-bicyclo[2.2.1]heptanyl)-N-(6-methoxy-3-pyridinyl)acetamide
SMILESCOc1ccc(NC(=O)CC2CC3CCC2C3)cn1
InChIInChI=1S/C15H20N2O2/c1-19-15-5-4-13(9-16-15)17-14(18)8-12-7-10-2-3-11(12)6-10/h4-5,9-12H,2-3,6-8H2,1H3,(H,17,18)
InChIKeyDQZUARKTEXWGKX-UHFFFAOYSA-N
XLogP2.86
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-bicyclo[2.2.1]heptanyl)-N-(6-methoxy-3-pyridinyl)acetamide?
The IUPAC name of 2-(2-bicyclo[2.2.1]heptanyl)-N-(6-methoxy-3-pyridinyl)acetamide (CID 4878967) is 2-(2-bicyclo[2.2.1]heptanyl)-N-(6-methoxy-3-pyridinyl)acetamide.
What is the SMILES notation for 2-(2-bicyclo[2.2.1]heptanyl)-N-(6-methoxy-3-pyridinyl)acetamide?
The canonical SMILES for 2-(2-bicyclo[2.2.1]heptanyl)-N-(6-methoxy-3-pyridinyl)acetamide is COc1ccc(NC(=O)CC2CC3CCC2C3)cn1.
What is the InChIKey of 2-(2-bicyclo[2.2.1]heptanyl)-N-(6-methoxy-3-pyridinyl)acetamide?
The InChIKey is DQZUARKTEXWGKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-19-15-5-4-13(9-16-15)17-14(18)8-12-7-10-2-3-11(12)6-10/h4-5,9-12H,2-3,6-8H2,1H3,(H,17,18).
What are the key properties of 2-(2-bicyclo[2.2.1]heptanyl)-N-(6-methoxy-3-pyridinyl)acetamide?
2-(2-bicyclo[2.2.1]heptanyl)-N-(6-methoxy-3-pyridinyl)acetamide has a molecular weight of 260.34 g/mol, XLogP of 2.86, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bicyclo[2.2.1]heptanyl)-N-(6-methoxy-3-pyridinyl)acetamide is sourced from PubChem (CID 4878967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).