[2-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]pyrimidin-4-yl]methanol

C17H24N2O2Si — CID 140964248

IUPAC[2-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]pyrimidin-4-yl]methanol
SMILESCC(C)(C)[Si](C)(C)Oc1ccc(-c2nccc(CO)n2)cc1
InChIInChI=1S/C17H24N2O2Si/c1-17(2,3)22(4,5)21-15-8-6-13(7-9-15)16-18-11-10-14(12-20)19-16/h6-11,20H,12H2,1-5H3
InChIKeyUOCMYMLLZYCOET-UHFFFAOYSA-N
MW316.48 g/mol
LogP4.02
Rot. Bonds4

About [2-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]pyrimidin-4-yl]methanol

[2-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]pyrimidin-4-yl]methanol (PubChem CID 140964248) has the molecular formula C17H24N2O2Si and a molecular weight of 316.48 g/mol. Its IUPAC name is [2-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]pyrimidin-4-yl]methanol.

Molecular Properties

Compound Name[2-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]pyrimidin-4-yl]methanol
PubChem CID140964248
Molecular FormulaC17H24N2O2Si
Molecular Weight316.48 g/mol
Exact Mass316.16
IUPAC Name[2-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]pyrimidin-4-yl]methanol
SMILESCC(C)(C)[Si](C)(C)Oc1ccc(-c2nccc(CO)n2)cc1
InChIInChI=1S/C17H24N2O2Si/c1-17(2,3)22(4,5)21-15-8-6-13(7-9-15)16-18-11-10-14(12-20)19-16/h6-11,20H,12H2,1-5H3
InChIKeyUOCMYMLLZYCOET-UHFFFAOYSA-N
XLogP4.02
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.48
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[4-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]phenyl]ethanol
CID 150670696
[3-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]phenyl]methanol
CID 152503696
N-[[2-(4-methoxyphenyl)pyrimidin-4-yl]methyl]ethanamine
CID 46785129
[2-(3,5-dichlorophenyl)pyrimidin-4-yl]methanol
CID 107918136
[2-(3,5-difluorophenyl)pyrimidin-4-yl]methanol
CID 62749028
(2-thiophen-3-ylpyrimidin-4-yl)methanol
CID 62748849
2-[5-[tert-butyl(dimethyl)silyl]oxy-2-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]phenyl]propan-2-ol
CID 175597081
tert-butyl-[4-[(4-methoxyphenyl)methyl]phenoxy]-dimethylsilane
CID 23553287
2-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]aniline
CID 154489620
[4-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]-2-pyridinyl]methanol
CID 168916688
2-[2-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl]ethanol
CID 141113158
ethyl 4-[tert-butyl(dimethyl)silyl]oxybenzoate
CID 11289003

Frequently Asked Questions

What is the IUPAC name of [2-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]pyrimidin-4-yl]methanol?
The IUPAC name of [2-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]pyrimidin-4-yl]methanol (CID 140964248) is [2-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]pyrimidin-4-yl]methanol.
What is the SMILES notation for [2-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]pyrimidin-4-yl]methanol?
The canonical SMILES for [2-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]pyrimidin-4-yl]methanol is CC(C)(C)[Si](C)(C)Oc1ccc(-c2nccc(CO)n2)cc1.
What is the InChIKey of [2-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]pyrimidin-4-yl]methanol?
The InChIKey is UOCMYMLLZYCOET-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2Si/c1-17(2,3)22(4,5)21-15-8-6-13(7-9-15)16-18-11-10-14(12-20)19-16/h6-11,20H,12H2,1-5H3.
What are the key properties of [2-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]pyrimidin-4-yl]methanol?
[2-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]pyrimidin-4-yl]methanol has a molecular weight of 316.48 g/mol, XLogP of 4.02, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]pyrimidin-4-yl]methanol is sourced from PubChem (CID 140964248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).