(1-methyl-2-trimethylsilylpyrrolo[2,3-b]pyridin-3-yl)methanol

C12H18N2OSi — CID 86188870

IUPAC(1-methyl-2-trimethylsilylpyrrolo[2,3-b]pyridin-3-yl)methanol
SMILESCn1c([Si](C)(C)C)c(CO)c2cccnc21
InChIInChI=1S/C12H18N2OSi/c1-14-11-9(6-5-7-13-11)10(8-15)12(14)16(2,3)4/h5-7,15H,8H2,1-4H3
InChIKeyAJVPZTSSPDHBIY-UHFFFAOYSA-N
MW234.37 g/mol
LogP1.61
Rot. Bonds2

About (1-methyl-2-trimethylsilylpyrrolo[2,3-b]pyridin-3-yl)methanol

(1-methyl-2-trimethylsilylpyrrolo[2,3-b]pyridin-3-yl)methanol (PubChem CID 86188870) has the molecular formula C12H18N2OSi and a molecular weight of 234.37 g/mol. Its IUPAC name is (1-methyl-2-trimethylsilylpyrrolo[2,3-b]pyridin-3-yl)methanol.

Molecular Properties

Compound Name(1-methyl-2-trimethylsilylpyrrolo[2,3-b]pyridin-3-yl)methanol
PubChem CID86188870
Molecular FormulaC12H18N2OSi
Molecular Weight234.37 g/mol
Exact Mass234.12
IUPAC Name(1-methyl-2-trimethylsilylpyrrolo[2,3-b]pyridin-3-yl)methanol
SMILESCn1c([Si](C)(C)C)c(CO)c2cccnc21
InChIInChI=1S/C12H18N2OSi/c1-14-11-9(6-5-7-13-11)10(8-15)12(14)16(2,3)4/h5-7,15H,8H2,1-4H3
InChIKeyAJVPZTSSPDHBIY-UHFFFAOYSA-N
XLogP1.61
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.37
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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 (1-methyl-2-trimethylsilylpyrrolo[2,3-b]pyridin-3-yl)methanol?
The IUPAC name of (1-methyl-2-trimethylsilylpyrrolo[2,3-b]pyridin-3-yl)methanol (CID 86188870) is (1-methyl-2-trimethylsilylpyrrolo[2,3-b]pyridin-3-yl)methanol.
What is the SMILES notation for (1-methyl-2-trimethylsilylpyrrolo[2,3-b]pyridin-3-yl)methanol?
The canonical SMILES for (1-methyl-2-trimethylsilylpyrrolo[2,3-b]pyridin-3-yl)methanol is Cn1c([Si](C)(C)C)c(CO)c2cccnc21.
What is the InChIKey of (1-methyl-2-trimethylsilylpyrrolo[2,3-b]pyridin-3-yl)methanol?
The InChIKey is AJVPZTSSPDHBIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2OSi/c1-14-11-9(6-5-7-13-11)10(8-15)12(14)16(2,3)4/h5-7,15H,8H2,1-4H3.
What are the key properties of (1-methyl-2-trimethylsilylpyrrolo[2,3-b]pyridin-3-yl)methanol?
(1-methyl-2-trimethylsilylpyrrolo[2,3-b]pyridin-3-yl)methanol has a molecular weight of 234.37 g/mol, XLogP of 1.61, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methyl-2-trimethylsilylpyrrolo[2,3-b]pyridin-3-yl)methanol is sourced from PubChem (CID 86188870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).