N-(oxan-3-ylmethyl)-3-piperidin-4-yloxypropanamide

C14H26N2O3 — CID 63876312

IUPACN-(oxan-3-ylmethyl)-3-piperidin-4-yloxypropanamide
SMILESO=C(CCOC1CCNCC1)NCC1CCCOC1
InChIInChI=1S/C14H26N2O3/c17-14(16-10-12-2-1-8-18-11-12)5-9-19-13-3-6-15-7-4-13/h12-13,15H,1-11H2,(H,16,17)
InChIKeyJJJZBRDDOFYIQJ-UHFFFAOYSA-N
MW270.37 g/mol
LogP0.69
Rot. Bonds6

About N-(oxan-3-ylmethyl)-3-piperidin-4-yloxypropanamide

N-(oxan-3-ylmethyl)-3-piperidin-4-yloxypropanamide (PubChem CID 63876312) has the molecular formula C14H26N2O3 and a molecular weight of 270.37 g/mol. Its IUPAC name is N-(oxan-3-ylmethyl)-3-piperidin-4-yloxypropanamide.

Molecular Properties

Compound NameN-(oxan-3-ylmethyl)-3-piperidin-4-yloxypropanamide
PubChem CID63876312
Molecular FormulaC14H26N2O3
Molecular Weight270.37 g/mol
Exact Mass270.19
IUPAC NameN-(oxan-3-ylmethyl)-3-piperidin-4-yloxypropanamide
SMILESO=C(CCOC1CCNCC1)NCC1CCCOC1
InChIInChI=1S/C14H26N2O3/c17-14(16-10-12-2-1-8-18-11-12)5-9-19-13-3-6-15-7-4-13/h12-13,15H,1-11H2,(H,16,17)
InChIKeyJJJZBRDDOFYIQJ-UHFFFAOYSA-N
XLogP0.69
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(oxan-3-ylmethyl)-3-piperidin-4-yloxypropanamide?
The IUPAC name of N-(oxan-3-ylmethyl)-3-piperidin-4-yloxypropanamide (CID 63876312) is N-(oxan-3-ylmethyl)-3-piperidin-4-yloxypropanamide.
What is the SMILES notation for N-(oxan-3-ylmethyl)-3-piperidin-4-yloxypropanamide?
The canonical SMILES for N-(oxan-3-ylmethyl)-3-piperidin-4-yloxypropanamide is O=C(CCOC1CCNCC1)NCC1CCCOC1.
What is the InChIKey of N-(oxan-3-ylmethyl)-3-piperidin-4-yloxypropanamide?
The InChIKey is JJJZBRDDOFYIQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O3/c17-14(16-10-12-2-1-8-18-11-12)5-9-19-13-3-6-15-7-4-13/h12-13,15H,1-11H2,(H,16,17).
What are the key properties of N-(oxan-3-ylmethyl)-3-piperidin-4-yloxypropanamide?
N-(oxan-3-ylmethyl)-3-piperidin-4-yloxypropanamide has a molecular weight of 270.37 g/mol, XLogP of 0.69, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxan-3-ylmethyl)-3-piperidin-4-yloxypropanamide is sourced from PubChem (CID 63876312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).