10-(2,2-dimethylpropyl)-5-oxo-5-phenylacridophosphin-10-ol

C24H25O2P — CID 23280089

IUPAC10-(2,2-dimethylpropyl)-5-oxo-5-phenylacridophosphin-10-ol
SMILESCC(C)(C)CC1(O)c2ccccc2P(=O)(c2ccccc2)c2ccccc21
InChIInChI=1S/C24H25O2P/c1-23(2,3)17-24(25)19-13-7-9-15-21(19)27(26,18-11-5-4-6-12-18)22-16-10-8-14-20(22)24/h4-16,25H,17H2,1-3H3
InChIKeyXMRVCDVQJHGTMA-UHFFFAOYSA-N
MW376.44 g/mol
LogP4.31
Rot. Bonds2

About 10-(2,2-dimethylpropyl)-5-oxo-5-phenylacridophosphin-10-ol

10-(2,2-dimethylpropyl)-5-oxo-5-phenylacridophosphin-10-ol (PubChem CID 23280089) has the molecular formula C24H25O2P and a molecular weight of 376.44 g/mol. Its IUPAC name is 10-(2,2-dimethylpropyl)-5-oxo-5-phenylacridophosphin-10-ol.

Molecular Properties

Compound Name10-(2,2-dimethylpropyl)-5-oxo-5-phenylacridophosphin-10-ol
PubChem CID23280089
Molecular FormulaC24H25O2P
Molecular Weight376.44 g/mol
Exact Mass376.16
IUPAC Name10-(2,2-dimethylpropyl)-5-oxo-5-phenylacridophosphin-10-ol
SMILESCC(C)(C)CC1(O)c2ccccc2P(=O)(c2ccccc2)c2ccccc21
InChIInChI=1S/C24H25O2P/c1-23(2,3)17-24(25)19-13-7-9-15-21(19)27(26,18-11-5-4-6-12-18)22-16-10-8-14-20(22)24/h4-16,25H,17H2,1-3H3
InChIKeyXMRVCDVQJHGTMA-UHFFFAOYSA-N
XLogP4.31
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.44
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-bromo-4,4-diethyl-1-phenylphosphinoline 1-oxide
CID 132604573
10-phenyl-5H-phenophosphazinine 10-oxide
CID 12550143
11-phenyl-3-oxa-11λ5-phosphatetracyclo[10.4.0.02,4.05,10]hexadeca-1(16),5,7,9,12,14-hexaene 11-oxide
CID 134395999
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
3-[4-(9,9-dimethyl-10-phenyl-10H-anthracen-2-yl)phenyl]-10,10-dimethyl-5-phenylacridophosphine 5-oxide
CID 153291882
2,5-dimethyl-1-phenyl-1λ5-phosphole 1-oxide
CID 59167240
2,2,4,4-tetramethyl-1-phenyl-3H-phosphinoline 1-oxide
CID 71385233
10-oxo-10-phenylphenoxaphosphinine-2,3,7,8-tetracarboxylic acid
CID 100921752
(5,10-dioxo-5-phenylacridophosphin-1-yl)boronic acid
CID 155666222
3-(2,2-dimethylpropyl)-3-methyl-1-phenylcyclobutan-1-ol
CID 100998579
5'-phenyl-2'-(9-phenylcarbazol-3-yl)spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene-13,10'-acridophosphine] 5'-oxide
CID 135140078
2-bromo-5-phenylbenzo[b]phosphindole 5-oxide
CID 134327267

Frequently Asked Questions

What is the IUPAC name of 10-(2,2-dimethylpropyl)-5-oxo-5-phenylacridophosphin-10-ol?
The IUPAC name of 10-(2,2-dimethylpropyl)-5-oxo-5-phenylacridophosphin-10-ol (CID 23280089) is 10-(2,2-dimethylpropyl)-5-oxo-5-phenylacridophosphin-10-ol.
What is the SMILES notation for 10-(2,2-dimethylpropyl)-5-oxo-5-phenylacridophosphin-10-ol?
The canonical SMILES for 10-(2,2-dimethylpropyl)-5-oxo-5-phenylacridophosphin-10-ol is CC(C)(C)CC1(O)c2ccccc2P(=O)(c2ccccc2)c2ccccc21.
What is the InChIKey of 10-(2,2-dimethylpropyl)-5-oxo-5-phenylacridophosphin-10-ol?
The InChIKey is XMRVCDVQJHGTMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25O2P/c1-23(2,3)17-24(25)19-13-7-9-15-21(19)27(26,18-11-5-4-6-12-18)22-16-10-8-14-20(22)24/h4-16,25H,17H2,1-3H3.
What are the key properties of 10-(2,2-dimethylpropyl)-5-oxo-5-phenylacridophosphin-10-ol?
10-(2,2-dimethylpropyl)-5-oxo-5-phenylacridophosphin-10-ol has a molecular weight of 376.44 g/mol, XLogP of 4.31, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(2,2-dimethylpropyl)-5-oxo-5-phenylacridophosphin-10-ol is sourced from PubChem (CID 23280089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).