(2R)-2-[dimethyl(phenyl)silyl]-2-[(1S,2S)-2-pentylcyclopropyl]ethanol

C18H30OSi — CID 15252454

IUPAC(2R)-2-[dimethyl(phenyl)silyl]-2-[(1S,2S)-2-pentylcyclopropyl]ethanol
SMILESCCCCC[C@H]1C[C@@H]1[C@H](CO)[Si](C)(C)c1ccccc1
InChIInChI=1S/C18H30OSi/c1-4-5-7-10-15-13-17(15)18(14-19)20(2,3)16-11-8-6-9-12-16/h6,8-9,11-12,15,17-19H,4-5,7,10,13-14H2,1-3H3/t15-,17-,18-/m0/s1
InChIKeyUNGVJZQQXFREJC-SZMVWBNQSA-N
MW290.52 g/mol
LogP4.18
Rot. Bonds8

About (2R)-2-[dimethyl(phenyl)silyl]-2-[(1S,2S)-2-pentylcyclopropyl]ethanol

(2R)-2-[dimethyl(phenyl)silyl]-2-[(1S,2S)-2-pentylcyclopropyl]ethanol (PubChem CID 15252454) has the molecular formula C18H30OSi and a molecular weight of 290.52 g/mol. Its IUPAC name is (2R)-2-[dimethyl(phenyl)silyl]-2-[(1S,2S)-2-pentylcyclopropyl]ethanol.

Molecular Properties

Compound Name(2R)-2-[dimethyl(phenyl)silyl]-2-[(1S,2S)-2-pentylcyclopropyl]ethanol
PubChem CID15252454
Molecular FormulaC18H30OSi
Molecular Weight290.52 g/mol
Exact Mass290.21
IUPAC Name(2R)-2-[dimethyl(phenyl)silyl]-2-[(1S,2S)-2-pentylcyclopropyl]ethanol
SMILESCCCCC[C@H]1C[C@@H]1[C@H](CO)[Si](C)(C)c1ccccc1
InChIInChI=1S/C18H30OSi/c1-4-5-7-10-15-13-17(15)18(14-19)20(2,3)16-11-8-6-9-12-16/h6,8-9,11-12,15,17-19H,4-5,7,10,13-14H2,1-3H3/t15-,17-,18-/m0/s1
InChIKeyUNGVJZQQXFREJC-SZMVWBNQSA-N
XLogP4.18
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.52
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(2S)-2-[dimethyl(phenyl)silyl]hexan-1-ol
CID 10752326
[(1S)-1-[(3S,4R,7R,8S)-7-[(1S)-1-[dimethyl(phenyl)silyl]heptyl]-4,8-dimethyl-2,2,6,6-tetraphenyl-1,5,2,6-dioxadisilocan-3-yl]heptyl]-dimethyl-phenylsilane
CID 102351538
(1R)-1-[(1R,2R)-2-dodecylcyclopropyl]prop-2-yn-1-ol
CID 138980510
(2-octylcyclopropyl)methanediol
CID 165392128
[(1R,2R)-2-hexylcyclopropyl]benzene
CID 100977396
1-chlorohexyl-dimethyl-phenylsilane
CID 14984372
[(1R,2S)-2-butylcyclopropyl]-trimethylsilylmethanol
CID 139829557
(2-pentylcyclopropyl)sulfonylbenzene
CID 10467407
tert-butyl-[[(2S,4S)-4-pentyloxetan-2-yl]methyl]-diphenylsilane
CID 102506110
2-octyl-4-phenylcyclohexan-1-ol
CID 63461451
dimethyl-(3-octylcyclobut-2-en-1-yl)-phenylsilane
CID 101095441
(2S)-2-[dimethyl(phenyl)silyl]but-3-en-1-ol
CID 134955377

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[dimethyl(phenyl)silyl]-2-[(1S,2S)-2-pentylcyclopropyl]ethanol?
The IUPAC name of (2R)-2-[dimethyl(phenyl)silyl]-2-[(1S,2S)-2-pentylcyclopropyl]ethanol (CID 15252454) is (2R)-2-[dimethyl(phenyl)silyl]-2-[(1S,2S)-2-pentylcyclopropyl]ethanol.
What is the SMILES notation for (2R)-2-[dimethyl(phenyl)silyl]-2-[(1S,2S)-2-pentylcyclopropyl]ethanol?
The canonical SMILES for (2R)-2-[dimethyl(phenyl)silyl]-2-[(1S,2S)-2-pentylcyclopropyl]ethanol is CCCCC[C@H]1C[C@@H]1[C@H](CO)[Si](C)(C)c1ccccc1.
What is the InChIKey of (2R)-2-[dimethyl(phenyl)silyl]-2-[(1S,2S)-2-pentylcyclopropyl]ethanol?
The InChIKey is UNGVJZQQXFREJC-SZMVWBNQSA-N. The full InChI is InChI=1S/C18H30OSi/c1-4-5-7-10-15-13-17(15)18(14-19)20(2,3)16-11-8-6-9-12-16/h6,8-9,11-12,15,17-19H,4-5,7,10,13-14H2,1-3H3/t15-,17-,18-/m0/s1.
What are the key properties of (2R)-2-[dimethyl(phenyl)silyl]-2-[(1S,2S)-2-pentylcyclopropyl]ethanol?
(2R)-2-[dimethyl(phenyl)silyl]-2-[(1S,2S)-2-pentylcyclopropyl]ethanol has a molecular weight of 290.52 g/mol, XLogP of 4.18, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[dimethyl(phenyl)silyl]-2-[(1S,2S)-2-pentylcyclopropyl]ethanol is sourced from PubChem (CID 15252454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).