3-methyl-1-phenyl-2-propylphosphindole 1-oxide

C18H19OP — CID 134842657

IUPAC3-methyl-1-phenyl-2-propylphosphindole 1-oxide
SMILESCCCC1=C(C)c2ccccc2P1(=O)c1ccccc1
InChIInChI=1S/C18H19OP/c1-3-9-17-14(2)16-12-7-8-13-18(16)20(17,19)15-10-5-4-6-11-15/h4-8,10-13H,3,9H2,1-2H3
InChIKeyIWRJNUXABBQUJD-UHFFFAOYSA-N
MW282.32 g/mol
LogP4.55
Rot. Bonds3

About 3-methyl-1-phenyl-2-propylphosphindole 1-oxide

3-methyl-1-phenyl-2-propylphosphindole 1-oxide (PubChem CID 134842657) has the molecular formula C18H19OP and a molecular weight of 282.32 g/mol. Its IUPAC name is 3-methyl-1-phenyl-2-propylphosphindole 1-oxide.

Molecular Properties

Compound Name3-methyl-1-phenyl-2-propylphosphindole 1-oxide
PubChem CID134842657
Molecular FormulaC18H19OP
Molecular Weight282.32 g/mol
Exact Mass282.12
IUPAC Name3-methyl-1-phenyl-2-propylphosphindole 1-oxide
SMILESCCCC1=C(C)c2ccccc2P1(=O)c1ccccc1
InChIInChI=1S/C18H19OP/c1-3-9-17-14(2)16-12-7-8-13-18(16)20(17,19)15-10-5-4-6-11-15/h4-8,10-13H,3,9H2,1-2H3
InChIKeyIWRJNUXABBQUJD-UHFFFAOYSA-N
XLogP4.55
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.32
LogP ≤ 54.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-heptadecyl-1,3-diphenylphosphindole 1-oxide
CID 164676848
2-[(3,5-dimethylphenyl)methyl]-1,3-diphenylphosphindole 1-oxide
CID 132600992
6-(deuteriomethyl)-14-phenyl-6λ5,14λ5-diphosphatetracyclo[9.2.1.05,13.07,12]tetradeca-1,3,5(13),7(12),8,10-hexaene 6,14-dioxide;tris(6,14-diphenyl-6λ5,14λ5-diphosphatetracyclo[9.2.1.05,13.07,12]tetradeca-1(13),2,4,7,9,11-hexaene 6,14-dioxide);propane
CID 159985686
2,3,7,8-tetramethyl-5,10-diphenylphosphanthrene 5,10-dioxide
CID 102415355
2-methyl-3-propylinden-1-one
CID 10465047
1-[4-[(1-oxo-1,3-diphenylphosphindol-2-yl)methyl]phenyl]ethanone
CID 132600999
2,5-dimethyl-1-phenyl-1λ5-phosphole 1-oxide
CID 59167240
2-bromo-5-phenylbenzo[b]phosphindole 5-oxide
CID 134327267
(9R)-9-phenylphosphindolo[2,3-b]pyridine 9-oxide
CID 139135915
10-phenyl-5H-phenophosphazinine 10-oxide
CID 12550143
(5,10-dioxo-5-phenylacridophosphin-1-yl)boronic acid
CID 155666222
2-methyl-3-propylnaphthalene-1,4-dione
CID 12765187

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-phenyl-2-propylphosphindole 1-oxide?
The IUPAC name of 3-methyl-1-phenyl-2-propylphosphindole 1-oxide (CID 134842657) is 3-methyl-1-phenyl-2-propylphosphindole 1-oxide.
What is the SMILES notation for 3-methyl-1-phenyl-2-propylphosphindole 1-oxide?
The canonical SMILES for 3-methyl-1-phenyl-2-propylphosphindole 1-oxide is CCCC1=C(C)c2ccccc2P1(=O)c1ccccc1.
What is the InChIKey of 3-methyl-1-phenyl-2-propylphosphindole 1-oxide?
The InChIKey is IWRJNUXABBQUJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19OP/c1-3-9-17-14(2)16-12-7-8-13-18(16)20(17,19)15-10-5-4-6-11-15/h4-8,10-13H,3,9H2,1-2H3.
What are the key properties of 3-methyl-1-phenyl-2-propylphosphindole 1-oxide?
3-methyl-1-phenyl-2-propylphosphindole 1-oxide has a molecular weight of 282.32 g/mol, XLogP of 4.55, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-phenyl-2-propylphosphindole 1-oxide is sourced from PubChem (CID 134842657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).