(2R)-2-(furan-2-yl)-1-(2-methylpropyl)piperidine

C13H21NO — CID 124500855

IUPAC(2R)-2-(furan-2-yl)-1-(2-methylpropyl)piperidine
SMILESCC(C)CN1CCCC[C@@H]1c1ccco1
InChIInChI=1S/C13H21NO/c1-11(2)10-14-8-4-3-6-12(14)13-7-5-9-15-13/h5,7,9,11-12H,3-4,6,8,10H2,1-2H3/t12-/m1/s1
InChIKeyGHMFLMLYUNSWQU-GFCCVEGCSA-N
MW207.32 g/mol
LogP3.46
Rot. Bonds3

About (2R)-2-(furan-2-yl)-1-(2-methylpropyl)piperidine

(2R)-2-(furan-2-yl)-1-(2-methylpropyl)piperidine (PubChem CID 124500855) has the molecular formula C13H21NO and a molecular weight of 207.32 g/mol. Its IUPAC name is (2R)-2-(furan-2-yl)-1-(2-methylpropyl)piperidine.

Molecular Properties

Compound Name(2R)-2-(furan-2-yl)-1-(2-methylpropyl)piperidine
PubChem CID124500855
Molecular FormulaC13H21NO
Molecular Weight207.32 g/mol
Exact Mass207.16
IUPAC Name(2R)-2-(furan-2-yl)-1-(2-methylpropyl)piperidine
SMILESCC(C)CN1CCCC[C@@H]1c1ccco1
InChIInChI=1S/C13H21NO/c1-11(2)10-14-8-4-3-6-12(14)13-7-5-9-15-13/h5,7,9,11-12H,3-4,6,8,10H2,1-2H3/t12-/m1/s1
InChIKeyGHMFLMLYUNSWQU-GFCCVEGCSA-N
XLogP3.46
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(furan-2-yl)-1-(2-methylpropyl)piperidine?
The IUPAC name of (2R)-2-(furan-2-yl)-1-(2-methylpropyl)piperidine (CID 124500855) is (2R)-2-(furan-2-yl)-1-(2-methylpropyl)piperidine.
What is the SMILES notation for (2R)-2-(furan-2-yl)-1-(2-methylpropyl)piperidine?
The canonical SMILES for (2R)-2-(furan-2-yl)-1-(2-methylpropyl)piperidine is CC(C)CN1CCCC[C@@H]1c1ccco1.
What is the InChIKey of (2R)-2-(furan-2-yl)-1-(2-methylpropyl)piperidine?
The InChIKey is GHMFLMLYUNSWQU-GFCCVEGCSA-N. The full InChI is InChI=1S/C13H21NO/c1-11(2)10-14-8-4-3-6-12(14)13-7-5-9-15-13/h5,7,9,11-12H,3-4,6,8,10H2,1-2H3/t12-/m1/s1.
What are the key properties of (2R)-2-(furan-2-yl)-1-(2-methylpropyl)piperidine?
(2R)-2-(furan-2-yl)-1-(2-methylpropyl)piperidine has a molecular weight of 207.32 g/mol, XLogP of 3.46, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(furan-2-yl)-1-(2-methylpropyl)piperidine is sourced from PubChem (CID 124500855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).