3-(5-methyloxolan-2-yl)-N-(2-piperidin-3-ylethyl)propanamide

C15H28N2O2 — CID 119557859

IUPAC3-(5-methyloxolan-2-yl)-N-(2-piperidin-3-ylethyl)propanamide
SMILESCC1CCC(CCC(=O)NCCC2CCCNC2)O1
InChIInChI=1S/C15H28N2O2/c1-12-4-5-14(19-12)6-7-15(18)17-10-8-13-3-2-9-16-11-13/h12-14,16H,2-11H2,1H3,(H,17,18)
InChIKeyVEKLPDPDQYBZEY-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.84
Rot. Bonds6

About 3-(5-methyloxolan-2-yl)-N-(2-piperidin-3-ylethyl)propanamide

3-(5-methyloxolan-2-yl)-N-(2-piperidin-3-ylethyl)propanamide (PubChem CID 119557859) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 3-(5-methyloxolan-2-yl)-N-(2-piperidin-3-ylethyl)propanamide.

Molecular Properties

Compound Name3-(5-methyloxolan-2-yl)-N-(2-piperidin-3-ylethyl)propanamide
PubChem CID119557859
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name3-(5-methyloxolan-2-yl)-N-(2-piperidin-3-ylethyl)propanamide
SMILESCC1CCC(CCC(=O)NCCC2CCCNC2)O1
InChIInChI=1S/C15H28N2O2/c1-12-4-5-14(19-12)6-7-15(18)17-10-8-13-3-2-9-16-11-13/h12-14,16H,2-11H2,1H3,(H,17,18)
InChIKeyVEKLPDPDQYBZEY-UHFFFAOYSA-N
XLogP1.84
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(5-methyloxolan-2-yl)-N-(2-piperidin-3-ylethyl)propanamide?
The IUPAC name of 3-(5-methyloxolan-2-yl)-N-(2-piperidin-3-ylethyl)propanamide (CID 119557859) is 3-(5-methyloxolan-2-yl)-N-(2-piperidin-3-ylethyl)propanamide.
What is the SMILES notation for 3-(5-methyloxolan-2-yl)-N-(2-piperidin-3-ylethyl)propanamide?
The canonical SMILES for 3-(5-methyloxolan-2-yl)-N-(2-piperidin-3-ylethyl)propanamide is CC1CCC(CCC(=O)NCCC2CCCNC2)O1.
What is the InChIKey of 3-(5-methyloxolan-2-yl)-N-(2-piperidin-3-ylethyl)propanamide?
The InChIKey is VEKLPDPDQYBZEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-12-4-5-14(19-12)6-7-15(18)17-10-8-13-3-2-9-16-11-13/h12-14,16H,2-11H2,1H3,(H,17,18).
What are the key properties of 3-(5-methyloxolan-2-yl)-N-(2-piperidin-3-ylethyl)propanamide?
3-(5-methyloxolan-2-yl)-N-(2-piperidin-3-ylethyl)propanamide has a molecular weight of 268.40 g/mol, XLogP of 1.84, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-methyloxolan-2-yl)-N-(2-piperidin-3-ylethyl)propanamide is sourced from PubChem (CID 119557859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).