(2S)-2-[tert-butyl(dimethyl)silyl]oxy-1,1-dipyridin-2-ylpropan-1-ol

C19H28N2O2Si — CID 10970004

IUPAC(2S)-2-[tert-butyl(dimethyl)silyl]oxy-1,1-dipyridin-2-ylpropan-1-ol
SMILESC[C@H](O[Si](C)(C)C(C)(C)C)C(O)(c1ccccn1)c1ccccn1
InChIInChI=1S/C19H28N2O2Si/c1-15(23-24(5,6)18(2,3)4)19(22,16-11-7-9-13-20-16)17-12-8-10-14-21-17/h7-15,22H,1-6H3/t15-/m0/s1
InChIKeyDCEIYRUFGAPZMT-HNNXBMFYSA-N
MW344.53 g/mol
LogP4.12
Rot. Bonds5

About (2S)-2-[tert-butyl(dimethyl)silyl]oxy-1,1-dipyridin-2-ylpropan-1-ol

(2S)-2-[tert-butyl(dimethyl)silyl]oxy-1,1-dipyridin-2-ylpropan-1-ol (PubChem CID 10970004) has the molecular formula C19H28N2O2Si and a molecular weight of 344.53 g/mol. Its IUPAC name is (2S)-2-[tert-butyl(dimethyl)silyl]oxy-1,1-dipyridin-2-ylpropan-1-ol.

Molecular Properties

Compound Name(2S)-2-[tert-butyl(dimethyl)silyl]oxy-1,1-dipyridin-2-ylpropan-1-ol
PubChem CID10970004
Molecular FormulaC19H28N2O2Si
Molecular Weight344.53 g/mol
Exact Mass344.19
IUPAC Name(2S)-2-[tert-butyl(dimethyl)silyl]oxy-1,1-dipyridin-2-ylpropan-1-ol
SMILESC[C@H](O[Si](C)(C)C(C)(C)C)C(O)(c1ccccn1)c1ccccn1
InChIInChI=1S/C19H28N2O2Si/c1-15(23-24(5,6)18(2,3)4)19(22,16-11-7-9-13-20-16)17-12-8-10-14-21-17/h7-15,22H,1-6H3/t15-/m0/s1
InChIKeyDCEIYRUFGAPZMT-HNNXBMFYSA-N
XLogP4.12
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.53
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze (2S)-2-[tert-butyl(dimethyl)silyl]oxy-1,1-dipyridin-2-ylpropan-1-ol with MolForge

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

Launch Full Analysis

Related Compounds

ethane;2-methyl-1,1-dipyridin-2-ylpropan-1-ol
CID 142343342
(2S)-3-methyl-2-pyridin-2-ylbutan-2-ol
CID 162467836
tert-butyl-[(1R,2S)-2-methoxy-1-pyridin-2-ylpropoxy]-dimethylsilane
CID 10516965
CID 162723245
CID 162723245
2-pyridin-2-ylbut-3-yn-2-ol
CID 16762502
dichloro(pyridin-2-yl)methanol;zirconium
CID 174374690
trimethyl(2-pyridin-2-ylpropan-2-yloxy)silane
CID 157386063
1,1,3,3-tetrafluoro-2-pyridin-2-ylpropan-2-ol
CID 153440698
2-pyridin-2-ylbutane-2,3-diamine
CID 87362021
2-(2-pyridin-2-ylpropan-2-yloxy)ethanol
CID 141291865
2-hydroxy-3-methyl-2-pyridin-2-ylbutanoic acid
CID 83698678
2-tert-butylpyridine;ethane;methane
CID 143332153

Frequently Asked Questions

What is the IUPAC name of (2S)-2-[tert-butyl(dimethyl)silyl]oxy-1,1-dipyridin-2-ylpropan-1-ol?
The IUPAC name of (2S)-2-[tert-butyl(dimethyl)silyl]oxy-1,1-dipyridin-2-ylpropan-1-ol (CID 10970004) is (2S)-2-[tert-butyl(dimethyl)silyl]oxy-1,1-dipyridin-2-ylpropan-1-ol.
What is the SMILES notation for (2S)-2-[tert-butyl(dimethyl)silyl]oxy-1,1-dipyridin-2-ylpropan-1-ol?
The canonical SMILES for (2S)-2-[tert-butyl(dimethyl)silyl]oxy-1,1-dipyridin-2-ylpropan-1-ol is C[C@H](O[Si](C)(C)C(C)(C)C)C(O)(c1ccccn1)c1ccccn1.
What is the InChIKey of (2S)-2-[tert-butyl(dimethyl)silyl]oxy-1,1-dipyridin-2-ylpropan-1-ol?
The InChIKey is DCEIYRUFGAPZMT-HNNXBMFYSA-N. The full InChI is InChI=1S/C19H28N2O2Si/c1-15(23-24(5,6)18(2,3)4)19(22,16-11-7-9-13-20-16)17-12-8-10-14-21-17/h7-15,22H,1-6H3/t15-/m0/s1.
What are the key properties of (2S)-2-[tert-butyl(dimethyl)silyl]oxy-1,1-dipyridin-2-ylpropan-1-ol?
(2S)-2-[tert-butyl(dimethyl)silyl]oxy-1,1-dipyridin-2-ylpropan-1-ol has a molecular weight of 344.53 g/mol, XLogP of 4.12, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-[tert-butyl(dimethyl)silyl]oxy-1,1-dipyridin-2-ylpropan-1-ol is sourced from PubChem (CID 10970004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).