N-(2-phenoxyethyl)-3-piperidin-4-ylpropanamide

C16H24N2O2 — CID 62211306

IUPACN-(2-phenoxyethyl)-3-piperidin-4-ylpropanamide
SMILESO=C(CCC1CCNCC1)NCCOc1ccccc1
InChIInChI=1S/C16H24N2O2/c19-16(7-6-14-8-10-17-11-9-14)18-12-13-20-15-4-2-1-3-5-15/h1-5,14,17H,6-13H2,(H,18,19)
InChIKeyIISLNZQQXLUJOV-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.96
Rot. Bonds7

About N-(2-phenoxyethyl)-3-piperidin-4-ylpropanamide

N-(2-phenoxyethyl)-3-piperidin-4-ylpropanamide (PubChem CID 62211306) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-(2-phenoxyethyl)-3-piperidin-4-ylpropanamide.

Molecular Properties

Compound NameN-(2-phenoxyethyl)-3-piperidin-4-ylpropanamide
PubChem CID62211306
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-(2-phenoxyethyl)-3-piperidin-4-ylpropanamide
SMILESO=C(CCC1CCNCC1)NCCOc1ccccc1
InChIInChI=1S/C16H24N2O2/c19-16(7-6-14-8-10-17-11-9-14)18-12-13-20-15-4-2-1-3-5-15/h1-5,14,17H,6-13H2,(H,18,19)
InChIKeyIISLNZQQXLUJOV-UHFFFAOYSA-N
XLogP1.96
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(3-phenoxypropyl)-3-piperidin-4-ylpropanamide
CID 62378766
N-[2-(3-methylphenoxy)ethyl]-3-piperidin-4-ylpropanamide
CID 62211308
3-phenoxy-N-(pyrrolidin-3-ylmethyl)propanamide
CID 80564423
2-(azetidin-3-yl)-N-(2-phenoxyethyl)acetamide
CID 64609991
N-(2-phenoxyethyl)-3-piperidin-4-ylbutanamide
CID 119684535
N-(3-phenoxypropyl)-2-piperidin-4-ylsulfanylacetamide
CID 114627443
N-[2-(4-benzylphenoxy)ethyl]-2-pyrrolidin-3-ylacetamide
CID 67648354
2-(2-phenoxyethoxy)-N-(2-pyrrolidin-3-ylethyl)acetamide
CID 119533647
N-[2-(cyclopropylmethoxy)ethyl]-3-piperidin-4-ylpropanamide
CID 113343484
N-[2-(2-fluorophenyl)ethyl]-3-piperidin-4-ylpropanamide
CID 62211196
3-methylsulfanyl-N-(2-phenoxyethyl)propanamide
CID 112794610
4-oxo-4-(2-phenoxyethylamino)butanoate
CID 9156478

Frequently Asked Questions

What is the IUPAC name of N-(2-phenoxyethyl)-3-piperidin-4-ylpropanamide?
The IUPAC name of N-(2-phenoxyethyl)-3-piperidin-4-ylpropanamide (CID 62211306) is N-(2-phenoxyethyl)-3-piperidin-4-ylpropanamide.
What is the SMILES notation for N-(2-phenoxyethyl)-3-piperidin-4-ylpropanamide?
The canonical SMILES for N-(2-phenoxyethyl)-3-piperidin-4-ylpropanamide is O=C(CCC1CCNCC1)NCCOc1ccccc1.
What is the InChIKey of N-(2-phenoxyethyl)-3-piperidin-4-ylpropanamide?
The InChIKey is IISLNZQQXLUJOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c19-16(7-6-14-8-10-17-11-9-14)18-12-13-20-15-4-2-1-3-5-15/h1-5,14,17H,6-13H2,(H,18,19).
What are the key properties of N-(2-phenoxyethyl)-3-piperidin-4-ylpropanamide?
N-(2-phenoxyethyl)-3-piperidin-4-ylpropanamide has a molecular weight of 276.38 g/mol, XLogP of 1.96, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenoxyethyl)-3-piperidin-4-ylpropanamide is sourced from PubChem (CID 62211306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).