(2R)-2-methyl-1-tri(propan-2-yl)silyloxypentan-3-one

C15H32O2Si — CID 71351358

IUPAC(2R)-2-methyl-1-tri(propan-2-yl)silyloxypentan-3-one
SMILESCCC(=O)[C@H](C)CO[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C15H32O2Si/c1-9-15(16)14(8)10-17-18(11(2)3,12(4)5)13(6)7/h11-14H,9-10H2,1-8H3/t14-/m1/s1
InChIKeyHRTKUGCAZZAEGN-CQSZACIVSA-N
MW272.50 g/mol
LogP4.79
Rot. Bonds8

About (2R)-2-methyl-1-tri(propan-2-yl)silyloxypentan-3-one

(2R)-2-methyl-1-tri(propan-2-yl)silyloxypentan-3-one (PubChem CID 71351358) has the molecular formula C15H32O2Si and a molecular weight of 272.50 g/mol. Its IUPAC name is (2R)-2-methyl-1-tri(propan-2-yl)silyloxypentan-3-one.

Molecular Properties

Compound Name(2R)-2-methyl-1-tri(propan-2-yl)silyloxypentan-3-one
PubChem CID71351358
Molecular FormulaC15H32O2Si
Molecular Weight272.50 g/mol
Exact Mass272.22
IUPAC Name(2R)-2-methyl-1-tri(propan-2-yl)silyloxypentan-3-one
SMILESCCC(=O)[C@H](C)CO[Si](C(C)C)(C(C)C)C(C)C
InChIInChI=1S/C15H32O2Si/c1-9-15(16)14(8)10-17-18(11(2)3,12(4)5)13(6)7/h11-14H,9-10H2,1-8H3/t14-/m1/s1
InChIKeyHRTKUGCAZZAEGN-CQSZACIVSA-N
XLogP4.79
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.50
LogP ≤ 54.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (2R)-2-methyl-1-tri(propan-2-yl)silyloxypentan-3-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

(4R)-5-[tert-butyl(dimethyl)silyl]oxy-4-methylpentan-2-one
CID 10657116
4-[2,3-Dimethylbutan-2-yl(dimethyl)silyl]oxybutan-2-one
CID 15142237
(3S)-3-methyl-4-triethylsilyloxybutan-2-one
CID 23624325
3-Methyl-2-butanone, 4-t-butyldimethylsilyloxy-
CID 594310
(2R)-1-[tert-butyl(dimethyl)silyl]oxy-2-methylpentan-3-one
CID 11368226
(4S)-5-[tert-butyl(dimethyl)silyl]oxy-4-methylpentan-2-one
CID 11746464
1-[Tert-butyl(dimethyl)silyl]oxy-2-methylpentan-3-one
CID 72819705
2-Butanone, 4-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-3-methyl-, (3S)-
CID 11229680
1-Triethylsilyloxypentan-3-one
CID 18622678
5-[Tert-butyl(dimethyl)silyl]oxypentane-2,3-dione
CID 59850474
1,5-Bis[[(1,1-dimethylethyl)dimethylsilyl]oxy]-3-pentanone
CID 86673008
(3S)-3-methyl-4-tri(propan-2-yl)silyloxybutan-2-one
CID 10967189

Frequently Asked Questions

What is the IUPAC name of (2R)-2-methyl-1-tri(propan-2-yl)silyloxypentan-3-one?
The IUPAC name of (2R)-2-methyl-1-tri(propan-2-yl)silyloxypentan-3-one (CID 71351358) is (2R)-2-methyl-1-tri(propan-2-yl)silyloxypentan-3-one.
What is the SMILES notation for (2R)-2-methyl-1-tri(propan-2-yl)silyloxypentan-3-one?
The canonical SMILES for (2R)-2-methyl-1-tri(propan-2-yl)silyloxypentan-3-one is CCC(=O)[C@H](C)CO[Si](C(C)C)(C(C)C)C(C)C.
What is the InChIKey of (2R)-2-methyl-1-tri(propan-2-yl)silyloxypentan-3-one?
The InChIKey is HRTKUGCAZZAEGN-CQSZACIVSA-N. The full InChI is InChI=1S/C15H32O2Si/c1-9-15(16)14(8)10-17-18(11(2)3,12(4)5)13(6)7/h11-14H,9-10H2,1-8H3/t14-/m1/s1.
What are the key properties of (2R)-2-methyl-1-tri(propan-2-yl)silyloxypentan-3-one?
(2R)-2-methyl-1-tri(propan-2-yl)silyloxypentan-3-one has a molecular weight of 272.50 g/mol, XLogP of 4.79, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-methyl-1-tri(propan-2-yl)silyloxypentan-3-one is sourced from PubChem (CID 71351358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).