[(2R,5R)-2-ethyl-5-indol-1-yloxolan-3-yl]oxy-dimethylphosphane

C16H22NO2P — CID 159078143

IUPAC[(2R,5R)-2-ethyl-5-indol-1-yloxolan-3-yl]oxy-dimethylphosphane
SMILESCC[C@H]1O[C@@H](n2ccc3ccccc32)CC1OP(C)C
InChIInChI=1S/C16H22NO2P/c1-4-14-15(19-20(2)3)11-16(18-14)17-10-9-12-7-5-6-8-13(12)17/h5-10,14-16H,4,11H2,1-3H3/t14-,15?,16-/m1/s1
InChIKeyKAMXKMKJATVEFY-YTPLPTRZSA-N
MW291.33 g/mol
LogP4.38
Rot. Bonds4

About [(2R,5R)-2-ethyl-5-indol-1-yloxolan-3-yl]oxy-dimethylphosphane

[(2R,5R)-2-ethyl-5-indol-1-yloxolan-3-yl]oxy-dimethylphosphane (PubChem CID 159078143) has the molecular formula C16H22NO2P and a molecular weight of 291.33 g/mol. Its IUPAC name is [(2R,5R)-2-ethyl-5-indol-1-yloxolan-3-yl]oxy-dimethylphosphane.

Molecular Properties

Compound Name[(2R,5R)-2-ethyl-5-indol-1-yloxolan-3-yl]oxy-dimethylphosphane
PubChem CID159078143
Molecular FormulaC16H22NO2P
Molecular Weight291.33 g/mol
Exact Mass291.14
IUPAC Name[(2R,5R)-2-ethyl-5-indol-1-yloxolan-3-yl]oxy-dimethylphosphane
SMILESCC[C@H]1O[C@@H](n2ccc3ccccc32)CC1OP(C)C
InChIInChI=1S/C16H22NO2P/c1-4-14-15(19-20(2)3)11-16(18-14)17-10-9-12-7-5-6-8-13(12)17/h5-10,14-16H,4,11H2,1-3H3/t14-,15?,16-/m1/s1
InChIKeyKAMXKMKJATVEFY-YTPLPTRZSA-N
XLogP4.38
TPSA23.39 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.33
LogP ≤ 54.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [(2R,5R)-2-ethyl-5-indol-1-yloxolan-3-yl]oxy-dimethylphosphane?
The IUPAC name of [(2R,5R)-2-ethyl-5-indol-1-yloxolan-3-yl]oxy-dimethylphosphane (CID 159078143) is [(2R,5R)-2-ethyl-5-indol-1-yloxolan-3-yl]oxy-dimethylphosphane.
What is the SMILES notation for [(2R,5R)-2-ethyl-5-indol-1-yloxolan-3-yl]oxy-dimethylphosphane?
The canonical SMILES for [(2R,5R)-2-ethyl-5-indol-1-yloxolan-3-yl]oxy-dimethylphosphane is CC[C@H]1O[C@@H](n2ccc3ccccc32)CC1OP(C)C.
What is the InChIKey of [(2R,5R)-2-ethyl-5-indol-1-yloxolan-3-yl]oxy-dimethylphosphane?
The InChIKey is KAMXKMKJATVEFY-YTPLPTRZSA-N. The full InChI is InChI=1S/C16H22NO2P/c1-4-14-15(19-20(2)3)11-16(18-14)17-10-9-12-7-5-6-8-13(12)17/h5-10,14-16H,4,11H2,1-3H3/t14-,15?,16-/m1/s1.
What are the key properties of [(2R,5R)-2-ethyl-5-indol-1-yloxolan-3-yl]oxy-dimethylphosphane?
[(2R,5R)-2-ethyl-5-indol-1-yloxolan-3-yl]oxy-dimethylphosphane has a molecular weight of 291.33 g/mol, XLogP of 4.38, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R,5R)-2-ethyl-5-indol-1-yloxolan-3-yl]oxy-dimethylphosphane is sourced from PubChem (CID 159078143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).