(1R,3S)-3-methyl-1-phenyl-2,3-dihydrophosphindole 1-oxide

C15H15OP — CID 23419049

IUPAC(1R,3S)-3-methyl-1-phenyl-2,3-dihydrophosphindole 1-oxide
SMILESC[C@@H]1C[P@@](=O)(c2ccccc2)c2ccccc21
InChIInChI=1S/C15H15OP/c1-12-11-17(16,13-7-3-2-4-8-13)15-10-6-5-9-14(12)15/h2-10,12H,11H2,1H3/t12-,17-/m1/s1
InChIKeySLSSHKBVGDGCBV-SJKOYZFVSA-N
MW242.26 g/mol
LogP3.12
Rot. Bonds1

About (1R,3S)-3-methyl-1-phenyl-2,3-dihydrophosphindole 1-oxide

(1R,3S)-3-methyl-1-phenyl-2,3-dihydrophosphindole 1-oxide (PubChem CID 23419049) has the molecular formula C15H15OP and a molecular weight of 242.26 g/mol. Its IUPAC name is (1R,3S)-3-methyl-1-phenyl-2,3-dihydrophosphindole 1-oxide.

Molecular Properties

Compound Name(1R,3S)-3-methyl-1-phenyl-2,3-dihydrophosphindole 1-oxide
PubChem CID23419049
Molecular FormulaC15H15OP
Molecular Weight242.26 g/mol
Exact Mass242.09
IUPAC Name(1R,3S)-3-methyl-1-phenyl-2,3-dihydrophosphindole 1-oxide
SMILESC[C@@H]1C[P@@](=O)(c2ccccc2)c2ccccc21
InChIInChI=1S/C15H15OP/c1-12-11-17(16,13-7-3-2-4-8-13)15-10-6-5-9-14(12)15/h2-10,12H,11H2,1H3/t12-,17-/m1/s1
InChIKeySLSSHKBVGDGCBV-SJKOYZFVSA-N
XLogP3.12
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.26
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (1R,3S)-3-methyl-1-phenyl-2,3-dihydrophosphindole 1-oxide?
The IUPAC name of (1R,3S)-3-methyl-1-phenyl-2,3-dihydrophosphindole 1-oxide (CID 23419049) is (1R,3S)-3-methyl-1-phenyl-2,3-dihydrophosphindole 1-oxide.
What is the SMILES notation for (1R,3S)-3-methyl-1-phenyl-2,3-dihydrophosphindole 1-oxide?
The canonical SMILES for (1R,3S)-3-methyl-1-phenyl-2,3-dihydrophosphindole 1-oxide is C[C@@H]1C[P@@](=O)(c2ccccc2)c2ccccc21.
What is the InChIKey of (1R,3S)-3-methyl-1-phenyl-2,3-dihydrophosphindole 1-oxide?
The InChIKey is SLSSHKBVGDGCBV-SJKOYZFVSA-N. The full InChI is InChI=1S/C15H15OP/c1-12-11-17(16,13-7-3-2-4-8-13)15-10-6-5-9-14(12)15/h2-10,12H,11H2,1H3/t12-,17-/m1/s1.
What are the key properties of (1R,3S)-3-methyl-1-phenyl-2,3-dihydrophosphindole 1-oxide?
(1R,3S)-3-methyl-1-phenyl-2,3-dihydrophosphindole 1-oxide has a molecular weight of 242.26 g/mol, XLogP of 3.12, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,3S)-3-methyl-1-phenyl-2,3-dihydrophosphindole 1-oxide is sourced from PubChem (CID 23419049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).