2-[[(2R)-oxan-2-yl]methoxy]-N-(pyridin-3-ylmethyl)acetamide

C14H20N2O3 — CID 124756640

IUPAC2-[[(2R)-oxan-2-yl]methoxy]-N-(pyridin-3-ylmethyl)acetamide
SMILESO=C(COC[C@H]1CCCCO1)NCc1cccnc1
InChIInChI=1S/C14H20N2O3/c17-14(16-9-12-4-3-6-15-8-12)11-18-10-13-5-1-2-7-19-13/h3-4,6,8,13H,1-2,5,7,9-11H2,(H,16,17)/t13-/m1/s1
InChIKeyUERVJWOGPKFLFL-CYBMUJFWSA-N
MW264.32 g/mol
LogP1.28
Rot. Bonds6

About 2-[[(2R)-oxan-2-yl]methoxy]-N-(pyridin-3-ylmethyl)acetamide

2-[[(2R)-oxan-2-yl]methoxy]-N-(pyridin-3-ylmethyl)acetamide (PubChem CID 124756640) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is 2-[[(2R)-oxan-2-yl]methoxy]-N-(pyridin-3-ylmethyl)acetamide.

Molecular Properties

Compound Name2-[[(2R)-oxan-2-yl]methoxy]-N-(pyridin-3-ylmethyl)acetamide
PubChem CID124756640
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name2-[[(2R)-oxan-2-yl]methoxy]-N-(pyridin-3-ylmethyl)acetamide
SMILESO=C(COC[C@H]1CCCCO1)NCc1cccnc1
InChIInChI=1S/C14H20N2O3/c17-14(16-9-12-4-3-6-15-8-12)11-18-10-13-5-1-2-7-19-13/h3-4,6,8,13H,1-2,5,7,9-11H2,(H,16,17)/t13-/m1/s1
InChIKeyUERVJWOGPKFLFL-CYBMUJFWSA-N
XLogP1.28
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[[(2R)-oxan-2-yl]methoxy]-N-(pyridin-3-ylmethyl)acetamide?
The IUPAC name of 2-[[(2R)-oxan-2-yl]methoxy]-N-(pyridin-3-ylmethyl)acetamide (CID 124756640) is 2-[[(2R)-oxan-2-yl]methoxy]-N-(pyridin-3-ylmethyl)acetamide.
What is the SMILES notation for 2-[[(2R)-oxan-2-yl]methoxy]-N-(pyridin-3-ylmethyl)acetamide?
The canonical SMILES for 2-[[(2R)-oxan-2-yl]methoxy]-N-(pyridin-3-ylmethyl)acetamide is O=C(COC[C@H]1CCCCO1)NCc1cccnc1.
What is the InChIKey of 2-[[(2R)-oxan-2-yl]methoxy]-N-(pyridin-3-ylmethyl)acetamide?
The InChIKey is UERVJWOGPKFLFL-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H20N2O3/c17-14(16-9-12-4-3-6-15-8-12)11-18-10-13-5-1-2-7-19-13/h3-4,6,8,13H,1-2,5,7,9-11H2,(H,16,17)/t13-/m1/s1.
What are the key properties of 2-[[(2R)-oxan-2-yl]methoxy]-N-(pyridin-3-ylmethyl)acetamide?
2-[[(2R)-oxan-2-yl]methoxy]-N-(pyridin-3-ylmethyl)acetamide has a molecular weight of 264.32 g/mol, XLogP of 1.28, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(2R)-oxan-2-yl]methoxy]-N-(pyridin-3-ylmethyl)acetamide is sourced from PubChem (CID 124756640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).