(2R)-2-[2-(2-methylprop-2-enoxy)ethyl]piperidine

C11H21NO — CID 86320868

IUPAC(2R)-2-[2-(2-methylprop-2-enoxy)ethyl]piperidine
SMILESC=C(C)COCC[C@H]1CCCCN1
InChIInChI=1S/C11H21NO/c1-10(2)9-13-8-6-11-5-3-4-7-12-11/h11-12H,1,3-9H2,2H3/t11-/m1/s1
InChIKeyIMSCBVUGNDDAKM-LLVKDONJSA-N
MW183.29 g/mol
LogP2.11
Rot. Bonds5

About (2R)-2-[2-(2-methylprop-2-enoxy)ethyl]piperidine

(2R)-2-[2-(2-methylprop-2-enoxy)ethyl]piperidine (PubChem CID 86320868) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is (2R)-2-[2-(2-methylprop-2-enoxy)ethyl]piperidine.

Molecular Properties

Compound Name(2R)-2-[2-(2-methylprop-2-enoxy)ethyl]piperidine
PubChem CID86320868
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name(2R)-2-[2-(2-methylprop-2-enoxy)ethyl]piperidine
SMILESC=C(C)COCC[C@H]1CCCCN1
InChIInChI=1S/C11H21NO/c1-10(2)9-13-8-6-11-5-3-4-7-12-11/h11-12H,1,3-9H2,2H3/t11-/m1/s1
InChIKeyIMSCBVUGNDDAKM-LLVKDONJSA-N
XLogP2.11
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 52.11
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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Related Compounds

2-(Piperidin-2-yl)ethyl 2-methylprop-2-enoate
CID 29583
N-ethyl-6-(2-methylprop-2-enoxy)hexan-1-amine
CID 139904426
N-methyl-9-(2-methylprop-2-enoxy)nonan-1-amine
CID 169647721
2-[2-(Allyloxy)ethyl]piperidine hydrochloride
CID 53408893
2-(2-Prop-2-enoxyethyl)piperidine
CID 53408894
2-{2-[(2-Methyl-2-propenyl)oxy]ethyl}piperidine hydrochloride
CID 56830000
2-[2-(2-Methylprop-2-enoxy)ethyl]piperidine
CID 56830001
2-{2-[2-(Allyloxy)ethoxy]ethyl}piperidine hydrochloride
CID 56830008
2-[2-(2-Prop-2-enoxyethoxy)ethyl]piperidine
CID 56830009
2-(3-Methylbut-2-enoxymethyl)piperidine
CID 62339396
2-(2-Methylprop-2-enoxymethyl)piperidine
CID 62339397
2-[2-(2-Bromoprop-2-enoxy)ethyl]piperidine
CID 62341417

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[2-(2-methylprop-2-enoxy)ethyl]piperidine?
The IUPAC name of (2R)-2-[2-(2-methylprop-2-enoxy)ethyl]piperidine (CID 86320868) is (2R)-2-[2-(2-methylprop-2-enoxy)ethyl]piperidine.
What is the SMILES notation for (2R)-2-[2-(2-methylprop-2-enoxy)ethyl]piperidine?
The canonical SMILES for (2R)-2-[2-(2-methylprop-2-enoxy)ethyl]piperidine is C=C(C)COCC[C@H]1CCCCN1.
What is the InChIKey of (2R)-2-[2-(2-methylprop-2-enoxy)ethyl]piperidine?
The InChIKey is IMSCBVUGNDDAKM-LLVKDONJSA-N. The full InChI is InChI=1S/C11H21NO/c1-10(2)9-13-8-6-11-5-3-4-7-12-11/h11-12H,1,3-9H2,2H3/t11-/m1/s1.
What are the key properties of (2R)-2-[2-(2-methylprop-2-enoxy)ethyl]piperidine?
(2R)-2-[2-(2-methylprop-2-enoxy)ethyl]piperidine has a molecular weight of 183.29 g/mol, XLogP of 2.11, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[2-(2-methylprop-2-enoxy)ethyl]piperidine is sourced from PubChem (CID 86320868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).