8-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-chlorophenyl]-6,7-dihydro-5H-imidazo[1,5-a]pyridin-8-ol

C20H29ClN2O2Si — CID 68614831

IUPAC8-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-chlorophenyl]-6,7-dihydro-5H-imidazo[1,5-a]pyridin-8-ol
SMILESCC(C)(C)[Si](C)(C)OCc1ccc(Cl)cc1C1(O)CCCn2cncc21
InChIInChI=1S/C20H29ClN2O2Si/c1-19(2,3)26(4,5)25-13-15-7-8-16(21)11-17(15)20(24)9-6-10-23-14-22-12-18(20)23/h7-8,11-12,14,24H,6,9-10,13H2,1-5H3
InChIKeyVWQAKFJLCGVAJZ-UHFFFAOYSA-N
MW393.00 g/mol
LogP5.09
Rot. Bonds4

About 8-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-chlorophenyl]-6,7-dihydro-5H-imidazo[1,5-a]pyridin-8-ol

8-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-chlorophenyl]-6,7-dihydro-5H-imidazo[1,5-a]pyridin-8-ol (PubChem CID 68614831) has the molecular formula C20H29ClN2O2Si and a molecular weight of 393.00 g/mol. Its IUPAC name is 8-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-chlorophenyl]-6,7-dihydro-5H-imidazo[1,5-a]pyridin-8-ol.

Molecular Properties

Compound Name8-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-chlorophenyl]-6,7-dihydro-5H-imidazo[1,5-a]pyridin-8-ol
PubChem CID68614831
Molecular FormulaC20H29ClN2O2Si
Molecular Weight393.00 g/mol
Exact Mass392.17
IUPAC Name8-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-chlorophenyl]-6,7-dihydro-5H-imidazo[1,5-a]pyridin-8-ol
SMILESCC(C)(C)[Si](C)(C)OCc1ccc(Cl)cc1C1(O)CCCn2cncc21
InChIInChI=1S/C20H29ClN2O2Si/c1-19(2,3)26(4,5)25-13-15-7-8-16(21)11-17(15)20(24)9-6-10-23-14-22-12-18(20)23/h7-8,11-12,14,24H,6,9-10,13H2,1-5H3
InChIKeyVWQAKFJLCGVAJZ-UHFFFAOYSA-N
XLogP5.09
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500393.00
LogP ≤ 55.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 8-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-chlorophenyl]-6,7-dihydro-5H-imidazo[1,5-a]pyridin-8-ol?
The IUPAC name of 8-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-chlorophenyl]-6,7-dihydro-5H-imidazo[1,5-a]pyridin-8-ol (CID 68614831) is 8-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-chlorophenyl]-6,7-dihydro-5H-imidazo[1,5-a]pyridin-8-ol.
What is the SMILES notation for 8-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-chlorophenyl]-6,7-dihydro-5H-imidazo[1,5-a]pyridin-8-ol?
The canonical SMILES for 8-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-chlorophenyl]-6,7-dihydro-5H-imidazo[1,5-a]pyridin-8-ol is CC(C)(C)[Si](C)(C)OCc1ccc(Cl)cc1C1(O)CCCn2cncc21.
What is the InChIKey of 8-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-chlorophenyl]-6,7-dihydro-5H-imidazo[1,5-a]pyridin-8-ol?
The InChIKey is VWQAKFJLCGVAJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29ClN2O2Si/c1-19(2,3)26(4,5)25-13-15-7-8-16(21)11-17(15)20(24)9-6-10-23-14-22-12-18(20)23/h7-8,11-12,14,24H,6,9-10,13H2,1-5H3.
What are the key properties of 8-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-chlorophenyl]-6,7-dihydro-5H-imidazo[1,5-a]pyridin-8-ol?
8-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-chlorophenyl]-6,7-dihydro-5H-imidazo[1,5-a]pyridin-8-ol has a molecular weight of 393.00 g/mol, XLogP of 5.09, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-chlorophenyl]-6,7-dihydro-5H-imidazo[1,5-a]pyridin-8-ol is sourced from PubChem (CID 68614831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).