1-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]cyclobutan-1-ol

C15H26N2O2Si — CID 150333983

IUPAC1-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]cyclobutan-1-ol
SMILESCC(C)(C)[Si](C)(C)OCc1ccnc(C2(O)CCC2)n1
InChIInChI=1S/C15H26N2O2Si/c1-14(2,3)20(4,5)19-11-12-7-10-16-13(17-12)15(18)8-6-9-15/h7,10,18H,6,8-9,11H2,1-5H3
InChIKeyGQGVHTGHTXUCSB-UHFFFAOYSA-N
MW294.47 g/mol
LogP3.37
Rot. Bonds4

About 1-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]cyclobutan-1-ol

1-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]cyclobutan-1-ol (PubChem CID 150333983) has the molecular formula C15H26N2O2Si and a molecular weight of 294.47 g/mol. Its IUPAC name is 1-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]cyclobutan-1-ol.

Molecular Properties

Compound Name1-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]cyclobutan-1-ol
PubChem CID150333983
Molecular FormulaC15H26N2O2Si
Molecular Weight294.47 g/mol
Exact Mass294.18
IUPAC Name1-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]cyclobutan-1-ol
SMILESCC(C)(C)[Si](C)(C)OCc1ccnc(C2(O)CCC2)n1
InChIInChI=1S/C15H26N2O2Si/c1-14(2,3)20(4,5)19-11-12-7-10-16-13(17-12)15(18)8-6-9-15/h7,10,18H,6,8-9,11H2,1-5H3
InChIKeyGQGVHTGHTXUCSB-UHFFFAOYSA-N
XLogP3.37
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.47
LogP ≤ 53.37
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

1-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]-3,3-difluorocyclobutan-1-ol
CID 154620683
[(1R)-4-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]-1-methylcyclohex-3-en-1-yl]methanol
CID 154608214
2-[4-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]phenyl]ethanol
CID 150670696
1-[[tert-butyl(dimethyl)silyl]oxymethyl]cyclobutan-1-ol
CID 70362766
[3-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]phenyl]methanol
CID 152503696
ethyl 4-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]-1-methylcyclohex-3-ene-1-carboxylate
CID 151792264
[2-(1-ethoxycyclopentyl)pyrimidin-4-yl]methanol
CID 116778981
N-tert-butyl-6-[[tert-butyl(dimethyl)silyl]oxymethyl]pyridin-2-amine
CID 140891501
tert-butyl-dimethyl-[[2-[[(2S)-4-methyl-1,4-oxazepan-2-yl]methoxy]pyrimidin-4-yl]methoxy]silane
CID 154608291
3-[2-[[1-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]-4-fluoropiperidin-4-yl]methoxy]ethoxy]propane-1,2-diol
CID 151882012
tert-butyl-[[2-[(4S)-4-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxymethyl]-4-methylcyclohexen-1-yl]pyrimidin-4-yl]methoxy]-dimethylsilane
CID 150467451
(2-bromo-4-pyridinyl)methoxy-tert-butyl-dimethylsilane
CID 58538627

Frequently Asked Questions

What is the IUPAC name of 1-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]cyclobutan-1-ol?
The IUPAC name of 1-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]cyclobutan-1-ol (CID 150333983) is 1-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]cyclobutan-1-ol.
What is the SMILES notation for 1-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]cyclobutan-1-ol?
The canonical SMILES for 1-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]cyclobutan-1-ol is CC(C)(C)[Si](C)(C)OCc1ccnc(C2(O)CCC2)n1.
What is the InChIKey of 1-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]cyclobutan-1-ol?
The InChIKey is GQGVHTGHTXUCSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2Si/c1-14(2,3)20(4,5)19-11-12-7-10-16-13(17-12)15(18)8-6-9-15/h7,10,18H,6,8-9,11H2,1-5H3.
What are the key properties of 1-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]cyclobutan-1-ol?
1-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]cyclobutan-1-ol has a molecular weight of 294.47 g/mol, XLogP of 3.37, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrimidin-2-yl]cyclobutan-1-ol is sourced from PubChem (CID 150333983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).