piperidine;3-prop-2-enoxyprop-1-ene

C11H21NO — CID 118483077

IUPACpiperidine;3-prop-2-enoxyprop-1-ene
SMILESC1CCNCC1.C=CCOCC=C
InChIInChI=1S/C6H10O.C5H11N/c1-3-5-7-6-4-2;1-2-4-6-5-3-1/h3-4H,1-2,5-6H2;6H,1-5H2
InChIKeyARYAHLGNJJHVAT-UHFFFAOYSA-N
MW183.29 g/mol
LogP2.13
Rot. Bonds4

About piperidine;3-prop-2-enoxyprop-1-ene

piperidine;3-prop-2-enoxyprop-1-ene (PubChem CID 118483077) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is piperidine;3-prop-2-enoxyprop-1-ene.

Molecular Properties

Compound Namepiperidine;3-prop-2-enoxyprop-1-ene
PubChem CID118483077
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Namepiperidine;3-prop-2-enoxyprop-1-ene
SMILESC1CCNCC1.C=CCOCC=C
InChIInChI=1S/C6H10O.C5H11N/c1-3-5-7-6-4-2;1-2-4-6-5-3-1/h3-4H,1-2,5-6H2;6H,1-5H2
InChIKeyARYAHLGNJJHVAT-UHFFFAOYSA-N
XLogP2.13
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of piperidine;3-prop-2-enoxyprop-1-ene?
The IUPAC name of piperidine;3-prop-2-enoxyprop-1-ene (CID 118483077) is piperidine;3-prop-2-enoxyprop-1-ene.
What is the SMILES notation for piperidine;3-prop-2-enoxyprop-1-ene?
The canonical SMILES for piperidine;3-prop-2-enoxyprop-1-ene is C1CCNCC1.C=CCOCC=C.
What is the InChIKey of piperidine;3-prop-2-enoxyprop-1-ene?
The InChIKey is ARYAHLGNJJHVAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10O.C5H11N/c1-3-5-7-6-4-2;1-2-4-6-5-3-1/h3-4H,1-2,5-6H2;6H,1-5H2.
What are the key properties of piperidine;3-prop-2-enoxyprop-1-ene?
piperidine;3-prop-2-enoxyprop-1-ene has a molecular weight of 183.29 g/mol, XLogP of 2.13, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for piperidine;3-prop-2-enoxyprop-1-ene is sourced from PubChem (CID 118483077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).