N-[(3-methoxyoxolan-3-yl)methyl]-3-piperidin-3-ylpropanamide

C14H26N2O3 — CID 104761551

IUPACN-[(3-methoxyoxolan-3-yl)methyl]-3-piperidin-3-ylpropanamide
SMILESCOC1(CNC(=O)CCC2CCCNC2)CCOC1
InChIInChI=1S/C14H26N2O3/c1-18-14(6-8-19-11-14)10-16-13(17)5-4-12-3-2-7-15-9-12/h12,15H,2-11H2,1H3,(H,16,17)
InChIKeyUXKFGCBHHBQGRR-UHFFFAOYSA-N
MW270.37 g/mol
LogP0.69
Rot. Bonds6

About N-[(3-methoxyoxolan-3-yl)methyl]-3-piperidin-3-ylpropanamide

N-[(3-methoxyoxolan-3-yl)methyl]-3-piperidin-3-ylpropanamide (PubChem CID 104761551) has the molecular formula C14H26N2O3 and a molecular weight of 270.37 g/mol. Its IUPAC name is N-[(3-methoxyoxolan-3-yl)methyl]-3-piperidin-3-ylpropanamide.

Molecular Properties

Compound NameN-[(3-methoxyoxolan-3-yl)methyl]-3-piperidin-3-ylpropanamide
PubChem CID104761551
Molecular FormulaC14H26N2O3
Molecular Weight270.37 g/mol
Exact Mass270.19
IUPAC NameN-[(3-methoxyoxolan-3-yl)methyl]-3-piperidin-3-ylpropanamide
SMILESCOC1(CNC(=O)CCC2CCCNC2)CCOC1
InChIInChI=1S/C14H26N2O3/c1-18-14(6-8-19-11-14)10-16-13(17)5-4-12-3-2-7-15-9-12/h12,15H,2-11H2,1H3,(H,16,17)
InChIKeyUXKFGCBHHBQGRR-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-[(3-methoxyoxolan-3-yl)methyl]-3-piperidin-3-ylpropanamide?
The IUPAC name of N-[(3-methoxyoxolan-3-yl)methyl]-3-piperidin-3-ylpropanamide (CID 104761551) is N-[(3-methoxyoxolan-3-yl)methyl]-3-piperidin-3-ylpropanamide.
What is the SMILES notation for N-[(3-methoxyoxolan-3-yl)methyl]-3-piperidin-3-ylpropanamide?
The canonical SMILES for N-[(3-methoxyoxolan-3-yl)methyl]-3-piperidin-3-ylpropanamide is COC1(CNC(=O)CCC2CCCNC2)CCOC1.
What is the InChIKey of N-[(3-methoxyoxolan-3-yl)methyl]-3-piperidin-3-ylpropanamide?
The InChIKey is UXKFGCBHHBQGRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O3/c1-18-14(6-8-19-11-14)10-16-13(17)5-4-12-3-2-7-15-9-12/h12,15H,2-11H2,1H3,(H,16,17).
What are the key properties of N-[(3-methoxyoxolan-3-yl)methyl]-3-piperidin-3-ylpropanamide?
N-[(3-methoxyoxolan-3-yl)methyl]-3-piperidin-3-ylpropanamide 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-[(3-methoxyoxolan-3-yl)methyl]-3-piperidin-3-ylpropanamide is sourced from PubChem (CID 104761551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).