3-[[(diethoxyamino)-oxosilyl]-ethoxyamino]silylpropylurea

C10H26N4O5Si2 — CID 158983224

IUPAC3-[[(diethoxyamino)-oxosilyl]-ethoxyamino]silylpropylurea
SMILESCCON(OCC)[Si](=O)N(OCC)[SiH2]CCCNC(N)=O
InChIInChI=1S/C10H26N4O5Si2/c1-4-17-13(18-5-2)21(16)14(19-6-3)20-9-7-8-12-10(11)15/h4-9,20H2,1-3H3,(H3,11,12,15)
InChIKeyJPGHVMROPQEUQI-UHFFFAOYSA-N
MW338.51 g/mol
LogP-0.58
Rot. Bonds13

About 3-[[(diethoxyamino)-oxosilyl]-ethoxyamino]silylpropylurea

3-[[(diethoxyamino)-oxosilyl]-ethoxyamino]silylpropylurea (PubChem CID 158983224) has the molecular formula C10H26N4O5Si2 and a molecular weight of 338.51 g/mol. Its IUPAC name is 3-[[(diethoxyamino)-oxosilyl]-ethoxyamino]silylpropylurea.

Molecular Properties

Compound Name3-[[(diethoxyamino)-oxosilyl]-ethoxyamino]silylpropylurea
PubChem CID158983224
Molecular FormulaC10H26N4O5Si2
Molecular Weight338.51 g/mol
Exact Mass338.14
IUPAC Name3-[[(diethoxyamino)-oxosilyl]-ethoxyamino]silylpropylurea
SMILESCCON(OCC)[Si](=O)N(OCC)[SiH2]CCCNC(N)=O
InChIInChI=1S/C10H26N4O5Si2/c1-4-17-13(18-5-2)21(16)14(19-6-3)20-9-7-8-12-10(11)15/h4-9,20H2,1-3H3,(H3,11,12,15)
InChIKeyJPGHVMROPQEUQI-UHFFFAOYSA-N
XLogP-0.58
TPSA106.36 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds13
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.51
LogP ≤ 5-0.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

silane;3-triethoxysilylpropylurea
CID 161180470
3-triethoxysilylpropan-1-amine;3-triethoxysilylpropylurea
CID 88634615
3-(1,1-diethoxypropylsilyl)propylurea
CID 175352143
butylurea;silicic acid
CID 86735760
3-butoxypropylurea
CID 115575573
3-(3,3-diethoxypropoxysilyl)propylurea
CID 154499859
pentylurea;hydrate
CID 172845599
3-[3-(ethylamino)propoxy]propylurea
CID 22381168
3-chloropropylurea
CID 6421120
3-methoxypropylurea
CID 2064040
6-trimethoxysilylhexylurea
CID 87148927
ethyl 2-amino-5-(carbamoylamino)pentanoate;hydrochloride
CID 74933713

Frequently Asked Questions

What is the IUPAC name of 3-[[(diethoxyamino)-oxosilyl]-ethoxyamino]silylpropylurea?
The IUPAC name of 3-[[(diethoxyamino)-oxosilyl]-ethoxyamino]silylpropylurea (CID 158983224) is 3-[[(diethoxyamino)-oxosilyl]-ethoxyamino]silylpropylurea.
What is the SMILES notation for 3-[[(diethoxyamino)-oxosilyl]-ethoxyamino]silylpropylurea?
The canonical SMILES for 3-[[(diethoxyamino)-oxosilyl]-ethoxyamino]silylpropylurea is CCON(OCC)[Si](=O)N(OCC)[SiH2]CCCNC(N)=O.
What is the InChIKey of 3-[[(diethoxyamino)-oxosilyl]-ethoxyamino]silylpropylurea?
The InChIKey is JPGHVMROPQEUQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H26N4O5Si2/c1-4-17-13(18-5-2)21(16)14(19-6-3)20-9-7-8-12-10(11)15/h4-9,20H2,1-3H3,(H3,11,12,15).
What are the key properties of 3-[[(diethoxyamino)-oxosilyl]-ethoxyamino]silylpropylurea?
3-[[(diethoxyamino)-oxosilyl]-ethoxyamino]silylpropylurea has a molecular weight of 338.51 g/mol, XLogP of -0.58, 13 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[(diethoxyamino)-oxosilyl]-ethoxyamino]silylpropylurea is sourced from PubChem (CID 158983224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).