(2R)-2-[(1S,2S)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylcyclopentyl]propan-1-ol

C15H32O2Si — CID 10754690

IUPAC(2R)-2-[(1S,2S)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylcyclopentyl]propan-1-ol
SMILESC[C@@H]1C(O[Si](C)(C)C(C)(C)C)CC[C@H]1[C@@H](C)CO
InChIInChI=1S/C15H32O2Si/c1-11(10-16)13-8-9-14(12(13)2)17-18(6,7)15(3,4)5/h11-14,16H,8-10H2,1-7H3/t11-,12-,13-,14?/m0/s1
InChIKeyAJXMZOSZEGGUQH-AIOZOAKWSA-N
MW272.50 g/mol
LogP4.05
Rot. Bonds4

About (2R)-2-[(1S,2S)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylcyclopentyl]propan-1-ol

(2R)-2-[(1S,2S)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylcyclopentyl]propan-1-ol (PubChem CID 10754690) has the molecular formula C15H32O2Si and a molecular weight of 272.50 g/mol. Its IUPAC name is (2R)-2-[(1S,2S)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylcyclopentyl]propan-1-ol.

Molecular Properties

Compound Name(2R)-2-[(1S,2S)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylcyclopentyl]propan-1-ol
PubChem CID10754690
Molecular FormulaC15H32O2Si
Molecular Weight272.50 g/mol
Exact Mass272.22
IUPAC Name(2R)-2-[(1S,2S)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylcyclopentyl]propan-1-ol
SMILESC[C@@H]1C(O[Si](C)(C)C(C)(C)C)CC[C@H]1[C@@H](C)CO
InChIInChI=1S/C15H32O2Si/c1-11(10-16)13-8-9-14(12(13)2)17-18(6,7)15(3,4)5/h11-14,16H,8-10H2,1-7H3/t11-,12-,13-,14?/m0/s1
InChIKeyAJXMZOSZEGGUQH-AIOZOAKWSA-N
XLogP4.05
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.50
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 (2R)-2-[(1S,2S)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylcyclopentyl]propan-1-ol?
The IUPAC name of (2R)-2-[(1S,2S)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylcyclopentyl]propan-1-ol (CID 10754690) is (2R)-2-[(1S,2S)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylcyclopentyl]propan-1-ol.
What is the SMILES notation for (2R)-2-[(1S,2S)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylcyclopentyl]propan-1-ol?
The canonical SMILES for (2R)-2-[(1S,2S)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylcyclopentyl]propan-1-ol is C[C@@H]1C(O[Si](C)(C)C(C)(C)C)CC[C@H]1[C@@H](C)CO.
What is the InChIKey of (2R)-2-[(1S,2S)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylcyclopentyl]propan-1-ol?
The InChIKey is AJXMZOSZEGGUQH-AIOZOAKWSA-N. The full InChI is InChI=1S/C15H32O2Si/c1-11(10-16)13-8-9-14(12(13)2)17-18(6,7)15(3,4)5/h11-14,16H,8-10H2,1-7H3/t11-,12-,13-,14?/m0/s1.
What are the key properties of (2R)-2-[(1S,2S)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylcyclopentyl]propan-1-ol?
(2R)-2-[(1S,2S)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylcyclopentyl]propan-1-ol has a molecular weight of 272.50 g/mol, XLogP of 4.05, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(1S,2S)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylcyclopentyl]propan-1-ol is sourced from PubChem (CID 10754690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).