N-(1-ethoxypropan-2-yl)-3-piperidin-4-ylpropanamide

C13H26N2O2 — CID 55047644

IUPACN-(1-ethoxypropan-2-yl)-3-piperidin-4-ylpropanamide
SMILESCCOCC(C)NC(=O)CCC1CCNCC1
InChIInChI=1S/C13H26N2O2/c1-3-17-10-11(2)15-13(16)5-4-12-6-8-14-9-7-12/h11-12,14H,3-10H2,1-2H3,(H,15,16)
InChIKeyZXNRSZJWZIJCNM-UHFFFAOYSA-N
MW242.36 g/mol
LogP1.31
Rot. Bonds7

About N-(1-ethoxypropan-2-yl)-3-piperidin-4-ylpropanamide

N-(1-ethoxypropan-2-yl)-3-piperidin-4-ylpropanamide (PubChem CID 55047644) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is N-(1-ethoxypropan-2-yl)-3-piperidin-4-ylpropanamide.

Molecular Properties

Compound NameN-(1-ethoxypropan-2-yl)-3-piperidin-4-ylpropanamide
PubChem CID55047644
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC NameN-(1-ethoxypropan-2-yl)-3-piperidin-4-ylpropanamide
SMILESCCOCC(C)NC(=O)CCC1CCNCC1
InChIInChI=1S/C13H26N2O2/c1-3-17-10-11(2)15-13(16)5-4-12-6-8-14-9-7-12/h11-12,14H,3-10H2,1-2H3,(H,15,16)
InChIKeyZXNRSZJWZIJCNM-UHFFFAOYSA-N
XLogP1.31
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-ethoxypropan-2-yl)-3-piperidin-4-ylpropanamide?
The IUPAC name of N-(1-ethoxypropan-2-yl)-3-piperidin-4-ylpropanamide (CID 55047644) is N-(1-ethoxypropan-2-yl)-3-piperidin-4-ylpropanamide.
What is the SMILES notation for N-(1-ethoxypropan-2-yl)-3-piperidin-4-ylpropanamide?
The canonical SMILES for N-(1-ethoxypropan-2-yl)-3-piperidin-4-ylpropanamide is CCOCC(C)NC(=O)CCC1CCNCC1.
What is the InChIKey of N-(1-ethoxypropan-2-yl)-3-piperidin-4-ylpropanamide?
The InChIKey is ZXNRSZJWZIJCNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-3-17-10-11(2)15-13(16)5-4-12-6-8-14-9-7-12/h11-12,14H,3-10H2,1-2H3,(H,15,16).
What are the key properties of N-(1-ethoxypropan-2-yl)-3-piperidin-4-ylpropanamide?
N-(1-ethoxypropan-2-yl)-3-piperidin-4-ylpropanamide has a molecular weight of 242.36 g/mol, XLogP of 1.31, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethoxypropan-2-yl)-3-piperidin-4-ylpropanamide is sourced from PubChem (CID 55047644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).