Levoxadrol

C20H23NO2 — CID 14208378

IUPAC(2R)-2-[(4R)-2,2-diphenyl-1,3-dioxolan-4-yl]piperidine
SMILESC1CCN[C@H](C1)[C@@H]2COC(O2)(C3=CC=CC=C3)C4=CC=CC=C4
InChIInChI=1S/C20H23NO2/c1-3-9-16(10-4-1)20(17-11-5-2-6-12-17)22-15-19(23-20)18-13-7-8-14-21-18/h1-6,9-12,18-19,21H,7-8,13-15H2/t18-,19+/m1/s1
InChIKeyHGKAMARNFGKMLC-MOPGFXCFSA-N
MW309.40 g/mol
LogP3.40
Rot. Bonds3

About Levoxadrol

Levoxadrol (PubChem CID 14208378) has the molecular formula C20H23NO2 and a molecular weight of 309.40 g/mol. Its IUPAC name is (2R)-2-[(4R)-2,2-diphenyl-1,3-dioxolan-4-yl]piperidine.

Molecular Properties

Compound NameLevoxadrol
PubChem CID14208378
Molecular FormulaC20H23NO2
Molecular Weight309.40 g/mol
Exact Mass309.17
IUPAC Name(2R)-2-[(4R)-2,2-diphenyl-1,3-dioxolan-4-yl]piperidine
SMILESC1CCN[C@H](C1)[C@@H]2COC(O2)(C3=CC=CC=C3)C4=CC=CC=C4
InChIInChI=1S/C20H23NO2/c1-3-9-16(10-4-1)20(17-11-5-2-6-12-17)22-15-19(23-20)18-13-7-8-14-21-18/h1-6,9-12,18-19,21H,7-8,13-15H2/t18-,19+/m1/s1
InChIKeyHGKAMARNFGKMLC-MOPGFXCFSA-N
XLogP3.40
TPSA30.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity356

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.40
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of Levoxadrol?
The IUPAC name of Levoxadrol (CID 14208378) is (2R)-2-[(4R)-2,2-diphenyl-1,3-dioxolan-4-yl]piperidine.
What is the SMILES notation for Levoxadrol?
The canonical SMILES for Levoxadrol is C1CCN[C@H](C1)[C@@H]2COC(O2)(C3=CC=CC=C3)C4=CC=CC=C4.
What is the InChIKey of Levoxadrol?
The InChIKey is HGKAMARNFGKMLC-MOPGFXCFSA-N. The full InChI is InChI=1S/C20H23NO2/c1-3-9-16(10-4-1)20(17-11-5-2-6-12-17)22-15-19(23-20)18-13-7-8-14-21-18/h1-6,9-12,18-19,21H,7-8,13-15H2/t18-,19+/m1/s1.
What are the key properties of Levoxadrol?
Levoxadrol has a molecular weight of 309.40 g/mol, XLogP of 3.40, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for Levoxadrol is sourced from PubChem (CID 14208378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).