1-[diethoxy(methyl)silyl]pentane-1,5-diamine

C10H26N2O2Si — CID 174723153

IUPAC1-[diethoxy(methyl)silyl]pentane-1,5-diamine
SMILESCCO[Si](C)(OCC)C(N)CCCCN
InChIInChI=1S/C10H26N2O2Si/c1-4-13-15(3,14-5-2)10(12)8-6-7-9-11/h10H,4-9,11-12H2,1-3H3
InChIKeyWPOKGHOJNFLQPP-UHFFFAOYSA-N
MW234.42 g/mol
LogP1.13
Rot. Bonds9

About 1-[diethoxy(methyl)silyl]pentane-1,5-diamine

1-[diethoxy(methyl)silyl]pentane-1,5-diamine (PubChem CID 174723153) has the molecular formula C10H26N2O2Si and a molecular weight of 234.42 g/mol. Its IUPAC name is 1-[diethoxy(methyl)silyl]pentane-1,5-diamine.

Molecular Properties

Compound Name1-[diethoxy(methyl)silyl]pentane-1,5-diamine
PubChem CID174723153
Molecular FormulaC10H26N2O2Si
Molecular Weight234.42 g/mol
Exact Mass234.18
IUPAC Name1-[diethoxy(methyl)silyl]pentane-1,5-diamine
SMILESCCO[Si](C)(OCC)C(N)CCCCN
InChIInChI=1S/C10H26N2O2Si/c1-4-13-15(3,14-5-2)10(12)8-6-7-9-11/h10H,4-9,11-12H2,1-3H3
InChIKeyWPOKGHOJNFLQPP-UHFFFAOYSA-N
XLogP1.13
TPSA70.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.42
LogP ≤ 51.13
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'}

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Frequently Asked Questions

What is the IUPAC name of 1-[diethoxy(methyl)silyl]pentane-1,5-diamine?
The IUPAC name of 1-[diethoxy(methyl)silyl]pentane-1,5-diamine (CID 174723153) is 1-[diethoxy(methyl)silyl]pentane-1,5-diamine.
What is the SMILES notation for 1-[diethoxy(methyl)silyl]pentane-1,5-diamine?
The canonical SMILES for 1-[diethoxy(methyl)silyl]pentane-1,5-diamine is CCO[Si](C)(OCC)C(N)CCCCN.
What is the InChIKey of 1-[diethoxy(methyl)silyl]pentane-1,5-diamine?
The InChIKey is WPOKGHOJNFLQPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H26N2O2Si/c1-4-13-15(3,14-5-2)10(12)8-6-7-9-11/h10H,4-9,11-12H2,1-3H3.
What are the key properties of 1-[diethoxy(methyl)silyl]pentane-1,5-diamine?
1-[diethoxy(methyl)silyl]pentane-1,5-diamine has a molecular weight of 234.42 g/mol, XLogP of 1.13, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[diethoxy(methyl)silyl]pentane-1,5-diamine is sourced from PubChem (CID 174723153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).