N-(2-piperidin-4-yloxyethyl)oxane-3-carboxamide

C13H24N2O3 — CID 55251624

IUPACN-(2-piperidin-4-yloxyethyl)oxane-3-carboxamide
SMILESO=C(NCCOC1CCNCC1)C1CCCOC1
InChIInChI=1S/C13H24N2O3/c16-13(11-2-1-8-17-10-11)15-7-9-18-12-3-5-14-6-4-12/h11-12,14H,1-10H2,(H,15,16)
InChIKeyBHSAKTWFDILBGB-UHFFFAOYSA-N
MW256.35 g/mol
LogP0.30
Rot. Bonds5

About N-(2-piperidin-4-yloxyethyl)oxane-3-carboxamide

N-(2-piperidin-4-yloxyethyl)oxane-3-carboxamide (PubChem CID 55251624) has the molecular formula C13H24N2O3 and a molecular weight of 256.35 g/mol. Its IUPAC name is N-(2-piperidin-4-yloxyethyl)oxane-3-carboxamide.

Molecular Properties

Compound NameN-(2-piperidin-4-yloxyethyl)oxane-3-carboxamide
PubChem CID55251624
Molecular FormulaC13H24N2O3
Molecular Weight256.35 g/mol
Exact Mass256.18
IUPAC NameN-(2-piperidin-4-yloxyethyl)oxane-3-carboxamide
SMILESO=C(NCCOC1CCNCC1)C1CCCOC1
InChIInChI=1S/C13H24N2O3/c16-13(11-2-1-8-17-10-11)15-7-9-18-12-3-5-14-6-4-12/h11-12,14H,1-10H2,(H,15,16)
InChIKeyBHSAKTWFDILBGB-UHFFFAOYSA-N
XLogP0.30
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 50.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(4-aminocyclohexyl)oxyethyl]oxane-3-carboxamide
CID 63869806
N-(2-cyclopentyloxyethyl)piperidine-4-carboxamide
CID 63828643
(2S)-N-(2-piperidin-4-yloxyethyl)oxolane-2-carboxamide
CID 104856278
N-(2-piperidin-4-yloxyethyl)cyclopent-3-ene-1-carboxamide
CID 64767379
N-(3-piperidin-4-yloxypropyl)oxane-4-carboxamide
CID 63871444
N-(3-piperidin-4-yloxypropyl)cycloheptanecarboxamide
CID 63869278
N-(2-piperazin-1-ylethyl)oxane-3-carboxamide
CID 55109658
2-[2-(oxane-3-carbonylamino)ethoxy]acetic acid
CID 79457821
N-(3-cyclohexyloxypropyl)oxolane-3-carboxamide
CID 86850695
N-(3-piperazin-1-ylpropyl)oxane-3-carboxamide
CID 62760131
N-(2-piperidin-4-yloxyethyl)cyclohex-3-ene-1-carboxamide
CID 63870773
N-[2-(2-methylprop-2-enoxy)ethyl]oxane-3-carboxamide
CID 115700210

Frequently Asked Questions

What is the IUPAC name of N-(2-piperidin-4-yloxyethyl)oxane-3-carboxamide?
The IUPAC name of N-(2-piperidin-4-yloxyethyl)oxane-3-carboxamide (CID 55251624) is N-(2-piperidin-4-yloxyethyl)oxane-3-carboxamide.
What is the SMILES notation for N-(2-piperidin-4-yloxyethyl)oxane-3-carboxamide?
The canonical SMILES for N-(2-piperidin-4-yloxyethyl)oxane-3-carboxamide is O=C(NCCOC1CCNCC1)C1CCCOC1.
What is the InChIKey of N-(2-piperidin-4-yloxyethyl)oxane-3-carboxamide?
The InChIKey is BHSAKTWFDILBGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O3/c16-13(11-2-1-8-17-10-11)15-7-9-18-12-3-5-14-6-4-12/h11-12,14H,1-10H2,(H,15,16).
What are the key properties of N-(2-piperidin-4-yloxyethyl)oxane-3-carboxamide?
N-(2-piperidin-4-yloxyethyl)oxane-3-carboxamide has a molecular weight of 256.35 g/mol, XLogP of 0.30, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-piperidin-4-yloxyethyl)oxane-3-carboxamide is sourced from PubChem (CID 55251624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).