1,3-dimethyl-5-tri(propan-2-yl)silyloxy-1,3-diazinan-2-one

C15H32N2O2Si — CID 86703130

IUPAC1,3-dimethyl-5-tri(propan-2-yl)silyloxy-1,3-diazinan-2-one
SMILESCC(C)[Si](OC1CN(C)C(=O)N(C)C1)(C(C)C)C(C)C
InChIInChI=1S/C15H32N2O2Si/c1-11(2)20(12(3)4,13(5)6)19-14-9-16(7)15(18)17(8)10-14/h11-14H,9-10H2,1-8H3
InChIKeyQCQOCYMGEQSNBI-UHFFFAOYSA-N
MW300.52 g/mol
LogP3.54
Rot. Bonds5

About 1,3-dimethyl-5-tri(propan-2-yl)silyloxy-1,3-diazinan-2-one

1,3-dimethyl-5-tri(propan-2-yl)silyloxy-1,3-diazinan-2-one (PubChem CID 86703130) has the molecular formula C15H32N2O2Si and a molecular weight of 300.52 g/mol. Its IUPAC name is 1,3-dimethyl-5-tri(propan-2-yl)silyloxy-1,3-diazinan-2-one.

Molecular Properties

Compound Name1,3-dimethyl-5-tri(propan-2-yl)silyloxy-1,3-diazinan-2-one
PubChem CID86703130
Molecular FormulaC15H32N2O2Si
Molecular Weight300.52 g/mol
Exact Mass300.22
IUPAC Name1,3-dimethyl-5-tri(propan-2-yl)silyloxy-1,3-diazinan-2-one
SMILESCC(C)[Si](OC1CN(C)C(=O)N(C)C1)(C(C)C)C(C)C
InChIInChI=1S/C15H32N2O2Si/c1-11(2)20(12(3)4,13(5)6)19-14-9-16(7)15(18)17(8)10-14/h11-14H,9-10H2,1-8H3
InChIKeyQCQOCYMGEQSNBI-UHFFFAOYSA-N
XLogP3.54
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.52
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1,3-Bis-[(dimethyl-ethoxysilyl)methyl]tetrahydropyrimidin-2-one
CID 129792779
1,3,5-Tris[3-[dimethyl(propan-2-yloxy)silyl]propyl]-1,3,5-triazinane-2,4,6-trione
CID 58897733
5-Triisopropylsilanyloxy-tetrahydro-pyrimidin-2-one
CID 86703131
5-[2-Di(propan-2-yl)silylpropan-2-yloxy]-1,3-dimethyl-1,3-diazinan-2-one
CID 123609973
2-[(1,3-Dimethyl-2-oxo-1,3-diazinan-5-yl)oxy]propan-2-yl-di(propan-2-yl)silanylium
CID 145615372
1-[2-[Tert-butyl(dimethyl)silyl]oxyethyl]-3-methyl-1,3-diazinan-2-one
CID 155759605
5-[2-Di(propan-2-yl)silylpropoxy]-1,3-dimethyl-1,3-diazinan-2-one
CID 173721239
4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-N,N-dimethylpiperazine-1-carboxamide
CID 176121779

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-5-tri(propan-2-yl)silyloxy-1,3-diazinan-2-one?
The IUPAC name of 1,3-dimethyl-5-tri(propan-2-yl)silyloxy-1,3-diazinan-2-one (CID 86703130) is 1,3-dimethyl-5-tri(propan-2-yl)silyloxy-1,3-diazinan-2-one.
What is the SMILES notation for 1,3-dimethyl-5-tri(propan-2-yl)silyloxy-1,3-diazinan-2-one?
The canonical SMILES for 1,3-dimethyl-5-tri(propan-2-yl)silyloxy-1,3-diazinan-2-one is CC(C)[Si](OC1CN(C)C(=O)N(C)C1)(C(C)C)C(C)C.
What is the InChIKey of 1,3-dimethyl-5-tri(propan-2-yl)silyloxy-1,3-diazinan-2-one?
The InChIKey is QCQOCYMGEQSNBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O2Si/c1-11(2)20(12(3)4,13(5)6)19-14-9-16(7)15(18)17(8)10-14/h11-14H,9-10H2,1-8H3.
What are the key properties of 1,3-dimethyl-5-tri(propan-2-yl)silyloxy-1,3-diazinan-2-one?
1,3-dimethyl-5-tri(propan-2-yl)silyloxy-1,3-diazinan-2-one has a molecular weight of 300.52 g/mol, XLogP of 3.54, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-5-tri(propan-2-yl)silyloxy-1,3-diazinan-2-one is sourced from PubChem (CID 86703130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).