[3-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]phenyl]methanol

C18H26N2O2Si — CID 152503696

IUPAC[3-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]phenyl]methanol
SMILESCC(C)(C)[Si](C)(C)OCc1ccnc(-c2cccc(CO)c2)n1
InChIInChI=1S/C18H26N2O2Si/c1-18(2,3)23(4,5)22-13-16-9-10-19-17(20-16)15-8-6-7-14(11-15)12-21/h6-11,21H,12-13H2,1-5H3
InChIKeyYDZVRERCUFFDLH-UHFFFAOYSA-N
MW330.50 g/mol
LogP4.16
Rot. Bonds5

About [3-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]phenyl]methanol

[3-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]phenyl]methanol (PubChem CID 152503696) has the molecular formula C18H26N2O2Si and a molecular weight of 330.50 g/mol. Its IUPAC name is [3-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]phenyl]methanol.

Molecular Properties

Compound Name[3-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]phenyl]methanol
PubChem CID152503696
Molecular FormulaC18H26N2O2Si
Molecular Weight330.50 g/mol
Exact Mass330.18
IUPAC Name[3-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]phenyl]methanol
SMILESCC(C)(C)[Si](C)(C)OCc1ccnc(-c2cccc(CO)c2)n1
InChIInChI=1S/C18H26N2O2Si/c1-18(2,3)23(4,5)22-13-16-9-10-19-17(20-16)15-8-6-7-14(11-15)12-21/h6-11,21H,12-13H2,1-5H3
InChIKeyYDZVRERCUFFDLH-UHFFFAOYSA-N
XLogP4.16
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.50
LogP ≤ 54.16
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-(bromomethyl)phenyl]methoxy-tert-butyl-dimethylsilane;[3-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]methanol
CID 159353997
3-[[tert-butyl(dimethyl)silyl]oxymethyl]phenol
CID 14940556
[2-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]pyrimidin-4-yl]methanol
CID 140964248
[3-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]methanamine
CID 22049979
[3-(4,5-dimethylpyrimidin-2-yl)phenyl]methanol
CID 71028488
1-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]ethanone
CID 171363881
tert-butyl-dimethyl-[(3-methylphenyl)methoxy]silane
CID 22967275
tert-butyl [2-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]phenyl] carbonate
CID 151183101
(2-bromo-4-pyridinyl)methoxy-tert-butyl-dimethylsilane
CID 58538627
tert-butyl-[(3-iodophenyl)methoxy]-dimethylsilane
CID 66845200
1-[3-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]propan-1-one
CID 70662263

Frequently Asked Questions

What is the IUPAC name of [3-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]phenyl]methanol?
The IUPAC name of [3-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]phenyl]methanol (CID 152503696) is [3-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]phenyl]methanol.
What is the SMILES notation for [3-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]phenyl]methanol?
The canonical SMILES for [3-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]phenyl]methanol is CC(C)(C)[Si](C)(C)OCc1ccnc(-c2cccc(CO)c2)n1.
What is the InChIKey of [3-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]phenyl]methanol?
The InChIKey is YDZVRERCUFFDLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O2Si/c1-18(2,3)23(4,5)22-13-16-9-10-19-17(20-16)15-8-6-7-14(11-15)12-21/h6-11,21H,12-13H2,1-5H3.
What are the key properties of [3-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]phenyl]methanol?
[3-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]phenyl]methanol has a molecular weight of 330.50 g/mol, XLogP of 4.16, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]phenyl]methanol is sourced from PubChem (CID 152503696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).