2-[[tert-butyl(dimethyl)silyl]oxymethyl]-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one

C17H32N4O2Si — CID 66852704

IUPAC2-[[tert-butyl(dimethyl)silyl]oxymethyl]-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one
SMILESCC(C)(C)[Si](C)(C)OCN1C=C2C(=O)N(C3CCNCC3)CN2C1
InChIInChI=1S/C17H32N4O2Si/c1-17(2,3)24(4,5)23-13-19-10-15-16(22)21(12-20(15)11-19)14-6-8-18-9-7-14/h10,14,18H,6-9,11-13H2,1-5H3
InChIKeyDPEAZPQLCGGRBP-UHFFFAOYSA-N
MW352.56 g/mol
LogP1.93
Rot. Bonds4

About 2-[[tert-butyl(dimethyl)silyl]oxymethyl]-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one

2-[[tert-butyl(dimethyl)silyl]oxymethyl]-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one (PubChem CID 66852704) has the molecular formula C17H32N4O2Si and a molecular weight of 352.56 g/mol. Its IUPAC name is 2-[[tert-butyl(dimethyl)silyl]oxymethyl]-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one.

Molecular Properties

Compound Name2-[[tert-butyl(dimethyl)silyl]oxymethyl]-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one
PubChem CID66852704
Molecular FormulaC17H32N4O2Si
Molecular Weight352.56 g/mol
Exact Mass352.23
IUPAC Name2-[[tert-butyl(dimethyl)silyl]oxymethyl]-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one
SMILESCC(C)(C)[Si](C)(C)OCN1C=C2C(=O)N(C3CCNCC3)CN2C1
InChIInChI=1S/C17H32N4O2Si/c1-17(2,3)24(4,5)23-13-19-10-15-16(22)21(12-20(15)11-19)14-6-8-18-9-7-14/h10,14,18H,6-9,11-13H2,1-5H3
InChIKeyDPEAZPQLCGGRBP-UHFFFAOYSA-N
XLogP1.93
TPSA48.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.56
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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 2-[[tert-butyl(dimethyl)silyl]oxymethyl]-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one?
The IUPAC name of 2-[[tert-butyl(dimethyl)silyl]oxymethyl]-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one (CID 66852704) is 2-[[tert-butyl(dimethyl)silyl]oxymethyl]-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one.
What is the SMILES notation for 2-[[tert-butyl(dimethyl)silyl]oxymethyl]-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one?
The canonical SMILES for 2-[[tert-butyl(dimethyl)silyl]oxymethyl]-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one is CC(C)(C)[Si](C)(C)OCN1C=C2C(=O)N(C3CCNCC3)CN2C1.
What is the InChIKey of 2-[[tert-butyl(dimethyl)silyl]oxymethyl]-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one?
The InChIKey is DPEAZPQLCGGRBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N4O2Si/c1-17(2,3)24(4,5)23-13-19-10-15-16(22)21(12-20(15)11-19)14-6-8-18-9-7-14/h10,14,18H,6-9,11-13H2,1-5H3.
What are the key properties of 2-[[tert-butyl(dimethyl)silyl]oxymethyl]-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one?
2-[[tert-butyl(dimethyl)silyl]oxymethyl]-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one has a molecular weight of 352.56 g/mol, XLogP of 1.93, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[tert-butyl(dimethyl)silyl]oxymethyl]-6-piperidin-4-yl-3,5-dihydroimidazo[1,5-c]imidazol-7-one is sourced from PubChem (CID 66852704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).