N-[3-(oxan-4-yloxy)propyl]piperidine-2-carboxamide

C14H26N2O3 — CID 119334628

IUPACN-[3-(oxan-4-yloxy)propyl]piperidine-2-carboxamide
SMILESO=C(NCCCOC1CCOCC1)C1CCCCN1
InChIInChI=1S/C14H26N2O3/c17-14(13-4-1-2-7-15-13)16-8-3-9-19-12-5-10-18-11-6-12/h12-13,15H,1-11H2,(H,16,17)
InChIKeyUEOFRVSKSJTHFR-UHFFFAOYSA-N
MW270.37 g/mol
LogP0.83
Rot. Bonds6

About N-[3-(oxan-4-yloxy)propyl]piperidine-2-carboxamide

N-[3-(oxan-4-yloxy)propyl]piperidine-2-carboxamide (PubChem CID 119334628) has the molecular formula C14H26N2O3 and a molecular weight of 270.37 g/mol. Its IUPAC name is N-[3-(oxan-4-yloxy)propyl]piperidine-2-carboxamide.

Molecular Properties

Compound NameN-[3-(oxan-4-yloxy)propyl]piperidine-2-carboxamide
PubChem CID119334628
Molecular FormulaC14H26N2O3
Molecular Weight270.37 g/mol
Exact Mass270.19
IUPAC NameN-[3-(oxan-4-yloxy)propyl]piperidine-2-carboxamide
SMILESO=C(NCCCOC1CCOCC1)C1CCCCN1
InChIInChI=1S/C14H26N2O3/c17-14(13-4-1-2-7-15-13)16-8-3-9-19-12-5-10-18-11-6-12/h12-13,15H,1-11H2,(H,16,17)
InChIKeyUEOFRVSKSJTHFR-UHFFFAOYSA-N
XLogP0.83
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 ≤ 50.83
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-[3-(oxan-4-yloxy)propyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119334633
(2R)-N-(2-cyclohexyloxyethyl)piperidine-2-carboxamide;hydrochloride
CID 119746139
N-(3-ethoxypropyl)azepane-2-carboxamide
CID 64562798
(2S)-N-(5-methoxypentyl)piperidine-2-carboxamide
CID 103809997
N-(3-ethoxypropyl)azocane-2-carboxamide
CID 114240040
(2R)-N-(4-morpholin-4-ylbutyl)piperidine-2-carboxamide
CID 119852461
N-(oxan-4-ylmethyl)azocane-2-carboxamide
CID 114240145
N-(3-morpholin-4-ylpropyl)piperidine-2-carboxamide;dihydrochloride
CID 119827240
(2R)-N-(7-methyloctyl)piperidine-2-carboxamide
CID 103807890
N-(4,4,4-trifluorobutyl)piperidine-2-carboxamide
CID 81434241
N-(3-cyclohexyloxypropyl)oxolane-3-carboxamide
CID 86850695
N-(4-hydroxybutyl)azepane-2-carboxamide
CID 106842137

Frequently Asked Questions

What is the IUPAC name of N-[3-(oxan-4-yloxy)propyl]piperidine-2-carboxamide?
The IUPAC name of N-[3-(oxan-4-yloxy)propyl]piperidine-2-carboxamide (CID 119334628) is N-[3-(oxan-4-yloxy)propyl]piperidine-2-carboxamide.
What is the SMILES notation for N-[3-(oxan-4-yloxy)propyl]piperidine-2-carboxamide?
The canonical SMILES for N-[3-(oxan-4-yloxy)propyl]piperidine-2-carboxamide is O=C(NCCCOC1CCOCC1)C1CCCCN1.
What is the InChIKey of N-[3-(oxan-4-yloxy)propyl]piperidine-2-carboxamide?
The InChIKey is UEOFRVSKSJTHFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O3/c17-14(13-4-1-2-7-15-13)16-8-3-9-19-12-5-10-18-11-6-12/h12-13,15H,1-11H2,(H,16,17).
What are the key properties of N-[3-(oxan-4-yloxy)propyl]piperidine-2-carboxamide?
N-[3-(oxan-4-yloxy)propyl]piperidine-2-carboxamide has a molecular weight of 270.37 g/mol, XLogP of 0.83, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(oxan-4-yloxy)propyl]piperidine-2-carboxamide is sourced from PubChem (CID 119334628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).