(5R)-5-[(1S)-1-[tert-butyl(dimethyl)silyl]oxy-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]ethyl]oxolan-2-one

C17H32O5Si — CID 11187012

IUPAC(5R)-5-[(1S)-1-[tert-butyl(dimethyl)silyl]oxy-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]ethyl]oxolan-2-one
SMILESCC1(C)OC[C@H]([C@@](C)(O[Si](C)(C)C(C)(C)C)[C@H]2CCC(=O)O2)O1
InChIInChI=1S/C17H32O5Si/c1-15(2,3)23(7,8)22-17(6,12-9-10-14(18)20-12)13-11-19-16(4,5)21-13/h12-13H,9-11H2,1-8H3/t12-,13-,17+/m1/s1
InChIKeyGVSFBLDJWKOWPC-XNJGSVPQSA-N
MW344.52 g/mol
LogP3.62
Rot. Bonds4

About (5R)-5-[(1S)-1-[tert-butyl(dimethyl)silyl]oxy-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]ethyl]oxolan-2-one

(5R)-5-[(1S)-1-[tert-butyl(dimethyl)silyl]oxy-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]ethyl]oxolan-2-one (PubChem CID 11187012) has the molecular formula C17H32O5Si and a molecular weight of 344.52 g/mol. Its IUPAC name is (5R)-5-[(1S)-1-[tert-butyl(dimethyl)silyl]oxy-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]ethyl]oxolan-2-one.

Molecular Properties

Compound Name(5R)-5-[(1S)-1-[tert-butyl(dimethyl)silyl]oxy-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]ethyl]oxolan-2-one
PubChem CID11187012
Molecular FormulaC17H32O5Si
Molecular Weight344.52 g/mol
Exact Mass344.20
IUPAC Name(5R)-5-[(1S)-1-[tert-butyl(dimethyl)silyl]oxy-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]ethyl]oxolan-2-one
SMILESCC1(C)OC[C@H]([C@@](C)(O[Si](C)(C)C(C)(C)C)[C@H]2CCC(=O)O2)O1
InChIInChI=1S/C17H32O5Si/c1-15(2,3)23(7,8)22-17(6,12-9-10-14(18)20-12)13-11-19-16(4,5)21-13/h12-13H,9-11H2,1-8H3/t12-,13-,17+/m1/s1
InChIKeyGVSFBLDJWKOWPC-XNJGSVPQSA-N
XLogP3.62
TPSA53.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.52
LogP ≤ 53.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze (5R)-5-[(1S)-1-[tert-butyl(dimethyl)silyl]oxy-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]ethyl]oxolan-2-one 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

ethyl 3-[(4R,5R)-5-[(R)-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-trimethylsilyloxymethyl]-2,2-dimethyl-1,3-dioxolan-4-yl]propanoate
CID 15596056
(5S)-5-[(2R,5R,6S)-5-ethyl-6-methyl-5-triethylsilyloxyoxan-2-yl]-5-methyloxolan-2-one
CID 11013732
methyl (4R,5S)-5-[(1R,2S)-1-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-1-triethylsilyloxypropan-2-yl]-2,2-dimethyl-1,3-dioxolane-4-carboxylate
CID 11539292
ethyl 3-[(4S,5S)-5-[(1R)-1,2-bis[[tert-butyl(dimethyl)silyl]oxy]ethyl]-2,2-dimethyl-1,3-dioxolan-4-yl]propanoate
CID 44515757
methyl (4R,5S)-5-[tert-butyl(dimethyl)silyl]oxy-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-4-methylpentanoate
CID 134971262
(1R,3S,7R,8R,9S,13S,14R,17R)-13-methoxy-8-(methoxymethoxy)-9,13,17-trimethyl-17-triethylsilyloxy-6,18-dioxatricyclo[12.3.1.03,7]octadecan-5-one
CID 135025771
dimethyl (4R,5R)-2,2-dimethyl-4-(3-triethylsilyloxybutyl)-1,3-dioxolane-4,5-dicarboxylate
CID 155932018
(2R,3aR,6aS)-2-[(1S)-1-[tert-butyl(dimethyl)silyl]oxyethyl]-6a-methyl-2,3,3a,4-tetrahydrofuro[2,3-b]furan-5-one
CID 155934217
methyl (3R)-3-[(1S,2R)-2-[tert-butyl(dimethyl)silyl]oxy-1-methoxy-2-[(4S,5R)-2,2,5-trimethyl-1,3-dioxolan-4-yl]ethyl]hex-5-ynoate
CID 11729645
Ethyl 3-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-6,9-dioxaspiro[4.4]nonane-3-carboxylate
CID 90036628
ethyl 2-((3aR,6R,6aS)-6-((tert-butyldimethylsilyl)oxy)hexahydrofuro[3,2-b]furan-3-yl)acetate
CID 90042502
(4S,5S)-5-(1-dimethylsilyloxy-2,2-dimethylpropyl)-4-(1,3-dioxolan-2-yl)oxolan-2-one
CID 173208042

Frequently Asked Questions

What is the IUPAC name of (5R)-5-[(1S)-1-[tert-butyl(dimethyl)silyl]oxy-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]ethyl]oxolan-2-one?
The IUPAC name of (5R)-5-[(1S)-1-[tert-butyl(dimethyl)silyl]oxy-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]ethyl]oxolan-2-one (CID 11187012) is (5R)-5-[(1S)-1-[tert-butyl(dimethyl)silyl]oxy-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]ethyl]oxolan-2-one.
What is the SMILES notation for (5R)-5-[(1S)-1-[tert-butyl(dimethyl)silyl]oxy-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]ethyl]oxolan-2-one?
The canonical SMILES for (5R)-5-[(1S)-1-[tert-butyl(dimethyl)silyl]oxy-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]ethyl]oxolan-2-one is CC1(C)OC[C@H]([C@@](C)(O[Si](C)(C)C(C)(C)C)[C@H]2CCC(=O)O2)O1.
What is the InChIKey of (5R)-5-[(1S)-1-[tert-butyl(dimethyl)silyl]oxy-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]ethyl]oxolan-2-one?
The InChIKey is GVSFBLDJWKOWPC-XNJGSVPQSA-N. The full InChI is InChI=1S/C17H32O5Si/c1-15(2,3)23(7,8)22-17(6,12-9-10-14(18)20-12)13-11-19-16(4,5)21-13/h12-13H,9-11H2,1-8H3/t12-,13-,17+/m1/s1.
What are the key properties of (5R)-5-[(1S)-1-[tert-butyl(dimethyl)silyl]oxy-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]ethyl]oxolan-2-one?
(5R)-5-[(1S)-1-[tert-butyl(dimethyl)silyl]oxy-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]ethyl]oxolan-2-one has a molecular weight of 344.52 g/mol, XLogP of 3.62, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-[(1S)-1-[tert-butyl(dimethyl)silyl]oxy-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]ethyl]oxolan-2-one is sourced from PubChem (CID 11187012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).