(3R,4S)-4-(furan-3-yl)-3-(naphthalen-2-ylmethoxy)piperidine

C20H21NO2 — CID 129385045

IUPAC(3R,4S)-4-(furan-3-yl)-3-(naphthalen-2-ylmethoxy)piperidine
SMILESc1ccc2cc(CO[C@H]3CNCC[C@H]3c3ccoc3)ccc2c1
InChIInChI=1S/C20H21NO2/c1-2-4-17-11-15(5-6-16(17)3-1)13-23-20-12-21-9-7-19(20)18-8-10-22-14-18/h1-6,8,10-11,14,19-21H,7,9,12-13H2/t19-,20-/m0/s1
InChIKeyCYWLFZAPKAXVAI-PMACEKPBSA-N
MW307.39 g/mol
LogP4.10
Rot. Bonds4

About (3R,4S)-4-(furan-3-yl)-3-(naphthalen-2-ylmethoxy)piperidine

(3R,4S)-4-(furan-3-yl)-3-(naphthalen-2-ylmethoxy)piperidine (PubChem CID 129385045) has the molecular formula C20H21NO2 and a molecular weight of 307.39 g/mol. Its IUPAC name is (3R,4S)-4-(furan-3-yl)-3-(naphthalen-2-ylmethoxy)piperidine.

Molecular Properties

Compound Name(3R,4S)-4-(furan-3-yl)-3-(naphthalen-2-ylmethoxy)piperidine
PubChem CID129385045
Molecular FormulaC20H21NO2
Molecular Weight307.39 g/mol
Exact Mass307.16
IUPAC Name(3R,4S)-4-(furan-3-yl)-3-(naphthalen-2-ylmethoxy)piperidine
SMILESc1ccc2cc(CO[C@H]3CNCC[C@H]3c3ccoc3)ccc2c1
InChIInChI=1S/C20H21NO2/c1-2-4-17-11-15(5-6-16(17)3-1)13-23-20-12-21-9-7-19(20)18-8-10-22-14-18/h1-6,8,10-11,14,19-21H,7,9,12-13H2/t19-,20-/m0/s1
InChIKeyCYWLFZAPKAXVAI-PMACEKPBSA-N
XLogP4.10
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.39
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3R,4R)-4-(furan-3-yl)-3-[(4-phenylphenyl)methoxy]piperidine
CID 59674730
4-(2-fluorophenyl)-3-(naphthalen-2-ylmethoxy)piperidine
CID 22128272
[3-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]phenyl]methanol
CID 70130180
3-(naphthalen-2-ylmethoxy)-4-(4-propylphenyl)piperidine
CID 173295938
4-(3-ethenoxyphenyl)-3-(naphthalen-2-ylmethoxy)piperidine
CID 57115568
2-[4-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]phenyl]acetic acid
CID 22127042
(3S,4S)-3-(naphthalen-2-ylmethoxy)-4-[4-(2-phenoxyethoxymethyl)phenyl]piperidine
CID 100967460
4-[4-[3-(4-methylphenoxy)propoxy]phenyl]-3-(naphthalen-2-ylmethoxy)piperidine
CID 140989345
methyl 3-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]benzoate
CID 54453046
(3S,4S)-3-(naphthalen-2-ylmethoxy)-4-[4-(3-phenylmethoxypropoxy)phenyl]piperidine
CID 100967467
3-(naphthalen-2-ylmethoxy)-4-[4-(2-phenylsulfanylethoxy)phenyl]piperidine
CID 22128244
4-[4-[3-[(4-iodophenyl)methoxy]propoxy]phenyl]-3-(naphthalen-2-ylmethoxy)piperidine
CID 22127509

Frequently Asked Questions

What is the IUPAC name of (3R,4S)-4-(furan-3-yl)-3-(naphthalen-2-ylmethoxy)piperidine?
The IUPAC name of (3R,4S)-4-(furan-3-yl)-3-(naphthalen-2-ylmethoxy)piperidine (CID 129385045) is (3R,4S)-4-(furan-3-yl)-3-(naphthalen-2-ylmethoxy)piperidine.
What is the SMILES notation for (3R,4S)-4-(furan-3-yl)-3-(naphthalen-2-ylmethoxy)piperidine?
The canonical SMILES for (3R,4S)-4-(furan-3-yl)-3-(naphthalen-2-ylmethoxy)piperidine is c1ccc2cc(CO[C@H]3CNCC[C@H]3c3ccoc3)ccc2c1.
What is the InChIKey of (3R,4S)-4-(furan-3-yl)-3-(naphthalen-2-ylmethoxy)piperidine?
The InChIKey is CYWLFZAPKAXVAI-PMACEKPBSA-N. The full InChI is InChI=1S/C20H21NO2/c1-2-4-17-11-15(5-6-16(17)3-1)13-23-20-12-21-9-7-19(20)18-8-10-22-14-18/h1-6,8,10-11,14,19-21H,7,9,12-13H2/t19-,20-/m0/s1.
What are the key properties of (3R,4S)-4-(furan-3-yl)-3-(naphthalen-2-ylmethoxy)piperidine?
(3R,4S)-4-(furan-3-yl)-3-(naphthalen-2-ylmethoxy)piperidine has a molecular weight of 307.39 g/mol, XLogP of 4.10, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,4S)-4-(furan-3-yl)-3-(naphthalen-2-ylmethoxy)piperidine is sourced from PubChem (CID 129385045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).