[5-chloro-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-4-yl]methanol

C17H27ClN2OSi — CID 141393855

IUPAC[5-chloro-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-4-yl]methanol
SMILESCC(C)[Si](C(C)C)(C(C)C)n1ccc2c(CO)c(Cl)cnc21
InChIInChI=1S/C17H27ClN2OSi/c1-11(2)22(12(3)4,13(5)6)20-8-7-14-15(10-21)16(18)9-19-17(14)20/h7-9,11-13,21H,10H2,1-6H3
InChIKeyLMDRFNPHWIUOOS-UHFFFAOYSA-N
MW338.96 g/mol
LogP5.21
Rot. Bonds5

About [5-chloro-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-4-yl]methanol

[5-chloro-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-4-yl]methanol (PubChem CID 141393855) has the molecular formula C17H27ClN2OSi and a molecular weight of 338.96 g/mol. Its IUPAC name is [5-chloro-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-4-yl]methanol.

Molecular Properties

Compound Name[5-chloro-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-4-yl]methanol
PubChem CID141393855
Molecular FormulaC17H27ClN2OSi
Molecular Weight338.96 g/mol
Exact Mass338.16
IUPAC Name[5-chloro-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-4-yl]methanol
SMILESCC(C)[Si](C(C)C)(C(C)C)n1ccc2c(CO)c(Cl)cnc21
InChIInChI=1S/C17H27ClN2OSi/c1-11(2)22(12(3)4,13(5)6)20-8-7-14-15(10-21)16(18)9-19-17(14)20/h7-9,11-13,21H,10H2,1-6H3
InChIKeyLMDRFNPHWIUOOS-UHFFFAOYSA-N
XLogP5.21
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.96
LogP ≤ 55.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze [5-chloro-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-4-yl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [5-chloro-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-4-yl]methanol?
The IUPAC name of [5-chloro-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-4-yl]methanol (CID 141393855) is [5-chloro-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-4-yl]methanol.
What is the SMILES notation for [5-chloro-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-4-yl]methanol?
The canonical SMILES for [5-chloro-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-4-yl]methanol is CC(C)[Si](C(C)C)(C(C)C)n1ccc2c(CO)c(Cl)cnc21.
What is the InChIKey of [5-chloro-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-4-yl]methanol?
The InChIKey is LMDRFNPHWIUOOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27ClN2OSi/c1-11(2)22(12(3)4,13(5)6)20-8-7-14-15(10-21)16(18)9-19-17(14)20/h7-9,11-13,21H,10H2,1-6H3.
What are the key properties of [5-chloro-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-4-yl]methanol?
[5-chloro-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-4-yl]methanol has a molecular weight of 338.96 g/mol, XLogP of 5.21, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-chloro-1-tri(propan-2-yl)silylpyrrolo[2,3-b]pyridin-4-yl]methanol is sourced from PubChem (CID 141393855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).