N-(2-piperidin-4-ylethyl)-3-propoxypropanamide

C13H26N2O2 — CID 62714933

IUPACN-(2-piperidin-4-ylethyl)-3-propoxypropanamide
SMILESCCCOCCC(=O)NCCC1CCNCC1
InChIInChI=1S/C13H26N2O2/c1-2-10-17-11-6-13(16)15-9-5-12-3-7-14-8-4-12/h12,14H,2-11H2,1H3,(H,15,16)
InChIKeyQBMPSSFCYUFNSZ-UHFFFAOYSA-N
MW242.36 g/mol
LogP1.31
Rot. Bonds8

About N-(2-piperidin-4-ylethyl)-3-propoxypropanamide

N-(2-piperidin-4-ylethyl)-3-propoxypropanamide (PubChem CID 62714933) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is N-(2-piperidin-4-ylethyl)-3-propoxypropanamide.

Molecular Properties

Compound NameN-(2-piperidin-4-ylethyl)-3-propoxypropanamide
PubChem CID62714933
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC NameN-(2-piperidin-4-ylethyl)-3-propoxypropanamide
SMILESCCCOCCC(=O)NCCC1CCNCC1
InChIInChI=1S/C13H26N2O2/c1-2-10-17-11-6-13(16)15-9-5-12-3-7-14-8-4-12/h12,14H,2-11H2,1H3,(H,15,16)
InChIKeyQBMPSSFCYUFNSZ-UHFFFAOYSA-N
XLogP1.31
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
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

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-(2-piperidin-4-ylethyl)-3-propoxypropanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(3-propoxypropyl)-3-pyrrolidin-3-ylpropanamide
CID 82941656
N-(2-cyclobutylethyl)-3-piperidin-4-ylpropanamide
CID 115870643
3-methoxy-N-(2-pyrrolidin-3-ylethyl)propanamide
CID 63630087
1-ethyl-3-(2-piperidin-4-ylethyl)urea
CID 60903315
3-(2-methoxyethoxy)-N-(2-piperidin-3-ylethyl)propanamide
CID 119558832
N-(2-cyclobutylethyl)-2-propoxyacetamide
CID 103747320
ethane;3-propoxy-N-propylpropanamide
CID 163269237
3-(2-propoxyethoxy)-N-propylpropanamide
CID 163586322
N-[2-(cyclopropylmethoxy)ethyl]-3-piperidin-4-ylpropanamide
CID 113343484
N-(azepan-4-yl)-3-propoxypropanamide
CID 107172337
N-[(4-methylpiperidin-3-yl)methyl]-3-propoxypropanamide
CID 114955778
N-(2-piperidin-4-ylethyl)acetamide;hydrochloride
CID 70084913

Frequently Asked Questions

What is the IUPAC name of N-(2-piperidin-4-ylethyl)-3-propoxypropanamide?
The IUPAC name of N-(2-piperidin-4-ylethyl)-3-propoxypropanamide (CID 62714933) is N-(2-piperidin-4-ylethyl)-3-propoxypropanamide.
What is the SMILES notation for N-(2-piperidin-4-ylethyl)-3-propoxypropanamide?
The canonical SMILES for N-(2-piperidin-4-ylethyl)-3-propoxypropanamide is CCCOCCC(=O)NCCC1CCNCC1.
What is the InChIKey of N-(2-piperidin-4-ylethyl)-3-propoxypropanamide?
The InChIKey is QBMPSSFCYUFNSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-2-10-17-11-6-13(16)15-9-5-12-3-7-14-8-4-12/h12,14H,2-11H2,1H3,(H,15,16).
What are the key properties of N-(2-piperidin-4-ylethyl)-3-propoxypropanamide?
N-(2-piperidin-4-ylethyl)-3-propoxypropanamide has a molecular weight of 242.36 g/mol, XLogP of 1.31, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-piperidin-4-ylethyl)-3-propoxypropanamide is sourced from PubChem (CID 62714933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).