2-[2-(9,9-dimethylacridin-10-yl)-5-trimethylsilylselenophen-3-yl]propan-2-ol

C25H31NOSeSi — CID 164816575

IUPAC2-[2-(9,9-dimethylacridin-10-yl)-5-trimethylsilylselenophen-3-yl]propan-2-ol
SMILESCC(C)(O)c1cc([Si](C)(C)C)[se]c1N1c2ccccc2C(C)(C)c2ccccc21
InChIInChI=1S/C25H31NOSeSi/c1-24(2)17-12-8-10-14-20(17)26(21-15-11-9-13-18(21)24)23-19(25(3,4)27)16-22(28-23)29(5,6)7/h8-16,27H,1-7H3
InChIKeyOLMJMSQCYXKIEO-UHFFFAOYSA-N
MW468.58 g/mol
LogP5.63
Rot. Bonds3

About 2-[2-(9,9-dimethylacridin-10-yl)-5-trimethylsilylselenophen-3-yl]propan-2-ol

2-[2-(9,9-dimethylacridin-10-yl)-5-trimethylsilylselenophen-3-yl]propan-2-ol (PubChem CID 164816575) has the molecular formula C25H31NOSeSi and a molecular weight of 468.58 g/mol. Its IUPAC name is 2-[2-(9,9-dimethylacridin-10-yl)-5-trimethylsilylselenophen-3-yl]propan-2-ol.

Molecular Properties

Compound Name2-[2-(9,9-dimethylacridin-10-yl)-5-trimethylsilylselenophen-3-yl]propan-2-ol
PubChem CID164816575
Molecular FormulaC25H31NOSeSi
Molecular Weight468.58 g/mol
Exact Mass469.13
IUPAC Name2-[2-(9,9-dimethylacridin-10-yl)-5-trimethylsilylselenophen-3-yl]propan-2-ol
SMILESCC(C)(O)c1cc([Si](C)(C)C)[se]c1N1c2ccccc2C(C)(C)c2ccccc21
InChIInChI=1S/C25H31NOSeSi/c1-24(2)17-12-8-10-14-20(17)26(21-15-11-9-13-18(21)24)23-19(25(3,4)27)16-22(28-23)29(5,6)7/h8-16,27H,1-7H3
InChIKeyOLMJMSQCYXKIEO-UHFFFAOYSA-N
XLogP5.63
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500468.58
LogP ≤ 55.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[2-(9,9-dimethylacridin-10-yl)selenophen-3-yl]propan-2-ol
CID 164816568
10-[8-(9,9-dimethylacridin-10-yl)quinoxalin-5-yl]-9,9-dimethylacridine
CID 121327146
10-[10-(9,9-dimethylacridin-10-yl)anthracen-9-yl]-9,9-dimethylacridine
CID 59399619
10-[5-(9,9-dimethylacridin-10-yl)thiophen-2-yl]-9,9-dimethylacridine
CID 59399701
10-[2-[7-[2-(9,9-dimethylacridin-10-yl)phenyl]-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dimethylacridine
CID 130438692
8,8,14,14-tetramethyl-11-[4-[4-(8,8,14,14-tetramethyl-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaen-11-yl)phenyl]phenyl]-1-azapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaene
CID 90330276
9,9,10-trimethylacridine
CID 610451
10-[3-(9,9-dimethylacridin-10-yl)-5-phenylphenyl]-9,9-dimethylacridine
CID 59399603
[3,5-bis[4-(9,9-dimethylacridin-10-yl)benzoyl]phenyl]-[4-(9,9-dimethylacridin-10-yl)phenyl]methanone
CID 121420430
2-(2-pyrrol-1-ylphenyl)propan-2-ol
CID 84820702
3-(9,9-dimethyl-10-phenylacridin-3-yl)-9,9-dimethyl-10-phenylacridine
CID 58489784
9,9-dimethyl-10-(6-methyl-3-pyridinyl)acridine
CID 118881708

Frequently Asked Questions

What is the IUPAC name of 2-[2-(9,9-dimethylacridin-10-yl)-5-trimethylsilylselenophen-3-yl]propan-2-ol?
The IUPAC name of 2-[2-(9,9-dimethylacridin-10-yl)-5-trimethylsilylselenophen-3-yl]propan-2-ol (CID 164816575) is 2-[2-(9,9-dimethylacridin-10-yl)-5-trimethylsilylselenophen-3-yl]propan-2-ol.
What is the SMILES notation for 2-[2-(9,9-dimethylacridin-10-yl)-5-trimethylsilylselenophen-3-yl]propan-2-ol?
The canonical SMILES for 2-[2-(9,9-dimethylacridin-10-yl)-5-trimethylsilylselenophen-3-yl]propan-2-ol is CC(C)(O)c1cc([Si](C)(C)C)[se]c1N1c2ccccc2C(C)(C)c2ccccc21.
What is the InChIKey of 2-[2-(9,9-dimethylacridin-10-yl)-5-trimethylsilylselenophen-3-yl]propan-2-ol?
The InChIKey is OLMJMSQCYXKIEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H31NOSeSi/c1-24(2)17-12-8-10-14-20(17)26(21-15-11-9-13-18(21)24)23-19(25(3,4)27)16-22(28-23)29(5,6)7/h8-16,27H,1-7H3.
What are the key properties of 2-[2-(9,9-dimethylacridin-10-yl)-5-trimethylsilylselenophen-3-yl]propan-2-ol?
2-[2-(9,9-dimethylacridin-10-yl)-5-trimethylsilylselenophen-3-yl]propan-2-ol has a molecular weight of 468.58 g/mol, XLogP of 5.63, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(9,9-dimethylacridin-10-yl)-5-trimethylsilylselenophen-3-yl]propan-2-ol is sourced from PubChem (CID 164816575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).