(5-methoxy-2,2-disilyloxypentyl)urea

C7H20N2O4Si2 — CID 175103467

IUPAC(5-methoxy-2,2-disilyloxypentyl)urea
SMILESCOCCCC(CNC(N)=O)(O[SiH3])O[SiH3]
InChIInChI=1S/C7H20N2O4Si2/c1-11-4-2-3-7(12-14,13-15)5-9-6(8)10/h2-5H2,1,14-15H3,(H3,8,9,10)
InChIKeyMZBBZQHENZTBIP-UHFFFAOYSA-N
MW252.42 g/mol
LogP-2.63
Rot. Bonds8

About (5-methoxy-2,2-disilyloxypentyl)urea

(5-methoxy-2,2-disilyloxypentyl)urea (PubChem CID 175103467) has the molecular formula C7H20N2O4Si2 and a molecular weight of 252.42 g/mol. Its IUPAC name is (5-methoxy-2,2-disilyloxypentyl)urea.

Molecular Properties

Compound Name(5-methoxy-2,2-disilyloxypentyl)urea
PubChem CID175103467
Molecular FormulaC7H20N2O4Si2
Molecular Weight252.42 g/mol
Exact Mass252.10
IUPAC Name(5-methoxy-2,2-disilyloxypentyl)urea
SMILESCOCCCC(CNC(N)=O)(O[SiH3])O[SiH3]
InChIInChI=1S/C7H20N2O4Si2/c1-11-4-2-3-7(12-14,13-15)5-9-6(8)10/h2-5H2,1,14-15H3,(H3,8,9,10)
InChIKeyMZBBZQHENZTBIP-UHFFFAOYSA-N
XLogP-2.63
TPSA82.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.42
LogP ≤ 5-2.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (5-methoxy-2,2-disilyloxypentyl)urea?
The IUPAC name of (5-methoxy-2,2-disilyloxypentyl)urea (CID 175103467) is (5-methoxy-2,2-disilyloxypentyl)urea.
What is the SMILES notation for (5-methoxy-2,2-disilyloxypentyl)urea?
The canonical SMILES for (5-methoxy-2,2-disilyloxypentyl)urea is COCCCC(CNC(N)=O)(O[SiH3])O[SiH3].
What is the InChIKey of (5-methoxy-2,2-disilyloxypentyl)urea?
The InChIKey is MZBBZQHENZTBIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H20N2O4Si2/c1-11-4-2-3-7(12-14,13-15)5-9-6(8)10/h2-5H2,1,14-15H3,(H3,8,9,10).
What are the key properties of (5-methoxy-2,2-disilyloxypentyl)urea?
(5-methoxy-2,2-disilyloxypentyl)urea has a molecular weight of 252.42 g/mol, XLogP of -2.63, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methoxy-2,2-disilyloxypentyl)urea is sourced from PubChem (CID 175103467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).