5-dimethoxysilylpentane-1,3-diamine

C7H20N2O2Si — CID 123921736

IUPAC5-dimethoxysilylpentane-1,3-diamine
SMILESCO[SiH](CCC(N)CCN)OC
InChIInChI=1S/C7H20N2O2Si/c1-10-12(11-2)6-4-7(9)3-5-8/h7,12H,3-6,8-9H2,1-2H3
InChIKeySQTSHRKDEDOZME-UHFFFAOYSA-N
MW192.33 g/mol
LogP-0.43
Rot. Bonds7

About 5-dimethoxysilylpentane-1,3-diamine

5-dimethoxysilylpentane-1,3-diamine (PubChem CID 123921736) has the molecular formula C7H20N2O2Si and a molecular weight of 192.33 g/mol. Its IUPAC name is 5-dimethoxysilylpentane-1,3-diamine.

Molecular Properties

Compound Name5-dimethoxysilylpentane-1,3-diamine
PubChem CID123921736
Molecular FormulaC7H20N2O2Si
Molecular Weight192.33 g/mol
Exact Mass192.13
IUPAC Name5-dimethoxysilylpentane-1,3-diamine
SMILESCO[SiH](CCC(N)CCN)OC
InChIInChI=1S/C7H20N2O2Si/c1-10-12(11-2)6-4-7(9)3-5-8/h7,12H,3-6,8-9H2,1-2H3
InChIKeySQTSHRKDEDOZME-UHFFFAOYSA-N
XLogP-0.43
TPSA70.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.33
LogP ≤ 5-0.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

6-dimethoxysilylhexane-1,3-diamine
CID 123164689
octane-1,3,6,8-tetramine
CID 18680656
4-dimethoxysilyl-2-methylbutan-1-amine
CID 154298922
dimethoxy(3-methylbutyl)silane;ethanamine
CID 173025352
1-N,1-N'-bis(2-aminoethyl)-3-dimethoxysilylpropane-1,1-diamine
CID 173120375
5-[ethoxy(methyl)silyl]pentane-1,3-diamine
CID 150032402
5-[methoxy(dimethyl)silyl]pentane-1,3-diamine
CID 87772527
ethane;(5R)-heptane-1,3,5,7-tetramine
CID 142330050
5-[2-(3,5-diaminopentoxy)propan-2-yloxy]pentane-1,3-diamine
CID 178166469
dimethoxy(pentyl)silane;propan-2-amine
CID 175239274
3,5-diaminopentan-1-ol;hydrobromide
CID 175509083
1-dimethoxysilylpentane-2,4-diamine
CID 175182162

Frequently Asked Questions

What is the IUPAC name of 5-dimethoxysilylpentane-1,3-diamine?
The IUPAC name of 5-dimethoxysilylpentane-1,3-diamine (CID 123921736) is 5-dimethoxysilylpentane-1,3-diamine.
What is the SMILES notation for 5-dimethoxysilylpentane-1,3-diamine?
The canonical SMILES for 5-dimethoxysilylpentane-1,3-diamine is CO[SiH](CCC(N)CCN)OC.
What is the InChIKey of 5-dimethoxysilylpentane-1,3-diamine?
The InChIKey is SQTSHRKDEDOZME-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H20N2O2Si/c1-10-12(11-2)6-4-7(9)3-5-8/h7,12H,3-6,8-9H2,1-2H3.
What are the key properties of 5-dimethoxysilylpentane-1,3-diamine?
5-dimethoxysilylpentane-1,3-diamine has a molecular weight of 192.33 g/mol, XLogP of -0.43, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-dimethoxysilylpentane-1,3-diamine is sourced from PubChem (CID 123921736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).