2-N,3-N-di(propan-2-yl)-6-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)hexane-2,3-diimine

C18H39N3Si2 — CID 10882738

IUPAC2-N,3-N-di(propan-2-yl)-6-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)hexane-2,3-diimine
SMILESCC(=N\C(C)C)/C(CCCN1[Si](C)(C)CC[Si]1(C)C)=N\C(C)C
InChIInChI=1S/C18H39N3Si2/c1-15(2)19-17(5)18(20-16(3)4)11-10-12-21-22(6,7)13-14-23(21,8)9/h15-16H,10-14H2,1-9H3/b19-17+,20-18-
InChIKeyMXDWXMKDTFJJFN-NADBREJJSA-N
MW353.70 g/mol
LogP5.21
Rot. Bonds7

About 2-N,3-N-di(propan-2-yl)-6-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)hexane-2,3-diimine

2-N,3-N-di(propan-2-yl)-6-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)hexane-2,3-diimine (PubChem CID 10882738) has the molecular formula C18H39N3Si2 and a molecular weight of 353.70 g/mol. Its IUPAC name is 2-N,3-N-di(propan-2-yl)-6-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)hexane-2,3-diimine.

Molecular Properties

Compound Name2-N,3-N-di(propan-2-yl)-6-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)hexane-2,3-diimine
PubChem CID10882738
Molecular FormulaC18H39N3Si2
Molecular Weight353.70 g/mol
Exact Mass353.27
IUPAC Name2-N,3-N-di(propan-2-yl)-6-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)hexane-2,3-diimine
SMILESCC(=N\C(C)C)/C(CCCN1[Si](C)(C)CC[Si]1(C)C)=N\C(C)C
InChIInChI=1S/C18H39N3Si2/c1-15(2)19-17(5)18(20-16(3)4)11-10-12-21-22(6,7)13-14-23(21,8)9/h15-16H,10-14H2,1-9H3/b19-17+,20-18-
InChIKeyMXDWXMKDTFJJFN-NADBREJJSA-N
XLogP5.21
TPSA27.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500353.70
LogP ≤ 55.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_one_A(321)', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-N,3-N-di(propan-2-yl)-6-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)hexane-2,3-diimine?
The IUPAC name of 2-N,3-N-di(propan-2-yl)-6-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)hexane-2,3-diimine (CID 10882738) is 2-N,3-N-di(propan-2-yl)-6-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)hexane-2,3-diimine.
What is the SMILES notation for 2-N,3-N-di(propan-2-yl)-6-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)hexane-2,3-diimine?
The canonical SMILES for 2-N,3-N-di(propan-2-yl)-6-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)hexane-2,3-diimine is CC(=N\C(C)C)/C(CCCN1[Si](C)(C)CC[Si]1(C)C)=N\C(C)C.
What is the InChIKey of 2-N,3-N-di(propan-2-yl)-6-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)hexane-2,3-diimine?
The InChIKey is MXDWXMKDTFJJFN-NADBREJJSA-N. The full InChI is InChI=1S/C18H39N3Si2/c1-15(2)19-17(5)18(20-16(3)4)11-10-12-21-22(6,7)13-14-23(21,8)9/h15-16H,10-14H2,1-9H3/b19-17+,20-18-.
What are the key properties of 2-N,3-N-di(propan-2-yl)-6-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)hexane-2,3-diimine?
2-N,3-N-di(propan-2-yl)-6-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)hexane-2,3-diimine has a molecular weight of 353.70 g/mol, XLogP of 5.21, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,3-N-di(propan-2-yl)-6-(2,2,5,5-tetramethyl-1,2,5-azadisilolidin-1-yl)hexane-2,3-diimine is sourced from PubChem (CID 10882738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).