2-hydroxy-1,3-diphenyl-4,5,6,7-tetrahydroisophosphindole

C20H19OP — CID 144905107

IUPAC2-hydroxy-1,3-diphenyl-4,5,6,7-tetrahydroisophosphindole
SMILESOp1c(-c2ccccc2)c2c(c1-c1ccccc1)CCCC2
InChIInChI=1S/C20H19OP/c21-22-19(15-9-3-1-4-10-15)17-13-7-8-14-18(17)20(22)16-11-5-2-6-12-16/h1-6,9-12,21H,7-8,13-14H2
InChIKeyNPZMLXKCUJXXNX-UHFFFAOYSA-N
MW306.35 g/mol
LogP5.64
Rot. Bonds2

About 2-hydroxy-1,3-diphenyl-4,5,6,7-tetrahydroisophosphindole

2-hydroxy-1,3-diphenyl-4,5,6,7-tetrahydroisophosphindole (PubChem CID 144905107) has the molecular formula C20H19OP and a molecular weight of 306.35 g/mol. Its IUPAC name is 2-hydroxy-1,3-diphenyl-4,5,6,7-tetrahydroisophosphindole.

Molecular Properties

Compound Name2-hydroxy-1,3-diphenyl-4,5,6,7-tetrahydroisophosphindole
PubChem CID144905107
Molecular FormulaC20H19OP
Molecular Weight306.35 g/mol
Exact Mass306.12
IUPAC Name2-hydroxy-1,3-diphenyl-4,5,6,7-tetrahydroisophosphindole
SMILESOp1c(-c2ccccc2)c2c(c1-c1ccccc1)CCCC2
InChIInChI=1S/C20H19OP/c21-22-19(15-9-3-1-4-10-15)17-13-7-8-14-18(17)20(22)16-11-5-2-6-12-16/h1-6,9-12,21H,7-8,13-14H2
InChIKeyNPZMLXKCUJXXNX-UHFFFAOYSA-N
XLogP5.64
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500306.35
LogP ≤ 55.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 91485242
3-phenylcyclohept-2-en-1-ol
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(1S)-3-phenylcyclohept-2-en-1-ol
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(1R)-3-phenylcyclohept-2-en-1-ol
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1,1'-biphenyl;cyclooctanone
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tetrakis(cyclohexylidenecyclohexane);phenol
CID 158567545
tetracyclo[6.6.5.02,7.09,14]nonadeca-1,3,5,7,9,11,13-heptaene
CID 14980237
tetracyclo[6.6.6.02,7.09,14]icosa-1,3,5,7,9,11,13-heptaene
CID 10015487
4-phenyl-N-(4-phenylphenyl)-N-[4-[10-(4-phenylphenyl)-1,2,3,4,5,6,7,8-octahydroanthracen-9-yl]phenyl]aniline
CID 118178056
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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-1,3-diphenyl-4,5,6,7-tetrahydroisophosphindole?
The IUPAC name of 2-hydroxy-1,3-diphenyl-4,5,6,7-tetrahydroisophosphindole (CID 144905107) is 2-hydroxy-1,3-diphenyl-4,5,6,7-tetrahydroisophosphindole.
What is the SMILES notation for 2-hydroxy-1,3-diphenyl-4,5,6,7-tetrahydroisophosphindole?
The canonical SMILES for 2-hydroxy-1,3-diphenyl-4,5,6,7-tetrahydroisophosphindole is Op1c(-c2ccccc2)c2c(c1-c1ccccc1)CCCC2.
What is the InChIKey of 2-hydroxy-1,3-diphenyl-4,5,6,7-tetrahydroisophosphindole?
The InChIKey is NPZMLXKCUJXXNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19OP/c21-22-19(15-9-3-1-4-10-15)17-13-7-8-14-18(17)20(22)16-11-5-2-6-12-16/h1-6,9-12,21H,7-8,13-14H2.
What are the key properties of 2-hydroxy-1,3-diphenyl-4,5,6,7-tetrahydroisophosphindole?
2-hydroxy-1,3-diphenyl-4,5,6,7-tetrahydroisophosphindole has a molecular weight of 306.35 g/mol, XLogP of 5.64, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-1,3-diphenyl-4,5,6,7-tetrahydroisophosphindole is sourced from PubChem (CID 144905107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).