(4R)-4-[dimethyl(phenyl)silyl]-5-(3-methoxyphenyl)pentan-1-ol

C20H28O2Si — CID 71561094

IUPAC(4R)-4-[dimethyl(phenyl)silyl]-5-(3-methoxyphenyl)pentan-1-ol
SMILESCOc1cccc(C[C@@H](CCCO)[Si](C)(C)c2ccccc2)c1
InChIInChI=1S/C20H28O2Si/c1-22-18-10-7-9-17(15-18)16-20(13-8-14-21)23(2,3)19-11-5-4-6-12-19/h4-7,9-12,15,20-21H,8,13-14,16H2,1-3H3/t20-/m1/s1
InChIKeyHSYGFSSELHDFQA-HXUWFJFHSA-N
MW328.53 g/mol
LogP4.00
Rot. Bonds8

About (4R)-4-[dimethyl(phenyl)silyl]-5-(3-methoxyphenyl)pentan-1-ol

(4R)-4-[dimethyl(phenyl)silyl]-5-(3-methoxyphenyl)pentan-1-ol (PubChem CID 71561094) has the molecular formula C20H28O2Si and a molecular weight of 328.53 g/mol. Its IUPAC name is (4R)-4-[dimethyl(phenyl)silyl]-5-(3-methoxyphenyl)pentan-1-ol.

Molecular Properties

Compound Name(4R)-4-[dimethyl(phenyl)silyl]-5-(3-methoxyphenyl)pentan-1-ol
PubChem CID71561094
Molecular FormulaC20H28O2Si
Molecular Weight328.53 g/mol
Exact Mass328.19
IUPAC Name(4R)-4-[dimethyl(phenyl)silyl]-5-(3-methoxyphenyl)pentan-1-ol
SMILESCOc1cccc(C[C@@H](CCCO)[Si](C)(C)c2ccccc2)c1
InChIInChI=1S/C20H28O2Si/c1-22-18-10-7-9-17(15-18)16-20(13-8-14-21)23(2,3)19-11-5-4-6-12-19/h4-7,9-12,15,20-21H,8,13-14,16H2,1-3H3/t20-/m1/s1
InChIKeyHSYGFSSELHDFQA-HXUWFJFHSA-N
XLogP4.00
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.53
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

[(1R)-2-(3-methoxyphenyl)-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethyl]-dimethyl-phenylsilane
CID 71561091
1-(3-methoxyphenyl)-4-phenylbutan-2-ol
CID 55136240
1-methoxy-3-(2-methoxypropyl)benzene
CID 56987806
1-methoxy-3-(3-methoxyphenyl)-1-phenylpropan-2-ol
CID 116757004
(2S)-2-amino-3-(3-methoxyphenyl)propan-1-ol
CID 28804581
(3-methoxyphenyl)(113C)methanol
CID 11593446
[(E)-3,6-bis[(3-methoxyphenyl)methyl]-5-trimethylsilyloxyoct-4-en-4-yl]oxy-trimethylsilane
CID 15120841
1-chloro-2-(3-methoxyphenyl)ethanamine
CID 67681258
1-(3-methoxyphenyl)pentan-2-ol
CID 61261615
4-(3-methoxyphenyl)-3-methylbutan-1-amine
CID 79002230
(2R)-3-(3-methoxyphenyl)-2-methylpropanoic acid
CID 42327175
5-chloro-1-(3-methoxyphenyl)pentan-2-ol
CID 66046833

Frequently Asked Questions

What is the IUPAC name of (4R)-4-[dimethyl(phenyl)silyl]-5-(3-methoxyphenyl)pentan-1-ol?
The IUPAC name of (4R)-4-[dimethyl(phenyl)silyl]-5-(3-methoxyphenyl)pentan-1-ol (CID 71561094) is (4R)-4-[dimethyl(phenyl)silyl]-5-(3-methoxyphenyl)pentan-1-ol.
What is the SMILES notation for (4R)-4-[dimethyl(phenyl)silyl]-5-(3-methoxyphenyl)pentan-1-ol?
The canonical SMILES for (4R)-4-[dimethyl(phenyl)silyl]-5-(3-methoxyphenyl)pentan-1-ol is COc1cccc(C[C@@H](CCCO)[Si](C)(C)c2ccccc2)c1.
What is the InChIKey of (4R)-4-[dimethyl(phenyl)silyl]-5-(3-methoxyphenyl)pentan-1-ol?
The InChIKey is HSYGFSSELHDFQA-HXUWFJFHSA-N. The full InChI is InChI=1S/C20H28O2Si/c1-22-18-10-7-9-17(15-18)16-20(13-8-14-21)23(2,3)19-11-5-4-6-12-19/h4-7,9-12,15,20-21H,8,13-14,16H2,1-3H3/t20-/m1/s1.
What are the key properties of (4R)-4-[dimethyl(phenyl)silyl]-5-(3-methoxyphenyl)pentan-1-ol?
(4R)-4-[dimethyl(phenyl)silyl]-5-(3-methoxyphenyl)pentan-1-ol has a molecular weight of 328.53 g/mol, XLogP of 4.00, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-[dimethyl(phenyl)silyl]-5-(3-methoxyphenyl)pentan-1-ol is sourced from PubChem (CID 71561094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).