1-[5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-pyridinyl]piperidin-4-ol

C17H30N2O2Si — CID 86730059

IUPAC1-[5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-pyridinyl]piperidin-4-ol
SMILESCC(C)(C)[Si](C)(C)OCc1ccc(N2CCC(O)CC2)nc1
InChIInChI=1S/C17H30N2O2Si/c1-17(2,3)22(4,5)21-13-14-6-7-16(18-12-14)19-10-8-15(20)9-11-19/h6-7,12,15,20H,8-11,13H2,1-5H3
InChIKeyOVRPPAVNVCRFIK-UHFFFAOYSA-N
MW322.53 g/mol
LogP3.56
Rot. Bonds4

About 1-[5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-pyridinyl]piperidin-4-ol

1-[5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-pyridinyl]piperidin-4-ol (PubChem CID 86730059) has the molecular formula C17H30N2O2Si and a molecular weight of 322.53 g/mol. Its IUPAC name is 1-[5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-pyridinyl]piperidin-4-ol.

Molecular Properties

Compound Name1-[5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-pyridinyl]piperidin-4-ol
PubChem CID86730059
Molecular FormulaC17H30N2O2Si
Molecular Weight322.53 g/mol
Exact Mass322.21
IUPAC Name1-[5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-pyridinyl]piperidin-4-ol
SMILESCC(C)(C)[Si](C)(C)OCc1ccc(N2CCC(O)CC2)nc1
InChIInChI=1S/C17H30N2O2Si/c1-17(2,3)22(4,5)21-13-14-6-7-16(18-12-14)19-10-8-15(20)9-11-19/h6-7,12,15,20H,8-11,13H2,1-5H3
InChIKeyOVRPPAVNVCRFIK-UHFFFAOYSA-N
XLogP3.56
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.53
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-pyridinyl]piperidin-4-ol?
The IUPAC name of 1-[5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-pyridinyl]piperidin-4-ol (CID 86730059) is 1-[5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-pyridinyl]piperidin-4-ol.
What is the SMILES notation for 1-[5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-pyridinyl]piperidin-4-ol?
The canonical SMILES for 1-[5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-pyridinyl]piperidin-4-ol is CC(C)(C)[Si](C)(C)OCc1ccc(N2CCC(O)CC2)nc1.
What is the InChIKey of 1-[5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-pyridinyl]piperidin-4-ol?
The InChIKey is OVRPPAVNVCRFIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2O2Si/c1-17(2,3)22(4,5)21-13-14-6-7-16(18-12-14)19-10-8-15(20)9-11-19/h6-7,12,15,20H,8-11,13H2,1-5H3.
What are the key properties of 1-[5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-pyridinyl]piperidin-4-ol?
1-[5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-pyridinyl]piperidin-4-ol has a molecular weight of 322.53 g/mol, XLogP of 3.56, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-pyridinyl]piperidin-4-ol is sourced from PubChem (CID 86730059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).