5-[ethoxy(methyl)silyl]pentane-1,3-diamine

C8H22N2OSi — CID 150032402

IUPAC5-[ethoxy(methyl)silyl]pentane-1,3-diamine
SMILESCCO[SiH](C)CCC(N)CCN
InChIInChI=1S/C8H22N2OSi/c1-3-11-12(2)7-5-8(10)4-6-9/h8,12H,3-7,9-10H2,1-2H3
InChIKeyDHNTULVMEJFNCS-UHFFFAOYSA-N
MW190.36 g/mol
LogP0.44
Rot. Bonds7

About 5-[ethoxy(methyl)silyl]pentane-1,3-diamine

5-[ethoxy(methyl)silyl]pentane-1,3-diamine (PubChem CID 150032402) has the molecular formula C8H22N2OSi and a molecular weight of 190.36 g/mol. Its IUPAC name is 5-[ethoxy(methyl)silyl]pentane-1,3-diamine.

Molecular Properties

Compound Name5-[ethoxy(methyl)silyl]pentane-1,3-diamine
PubChem CID150032402
Molecular FormulaC8H22N2OSi
Molecular Weight190.36 g/mol
Exact Mass190.15
IUPAC Name5-[ethoxy(methyl)silyl]pentane-1,3-diamine
SMILESCCO[SiH](C)CCC(N)CCN
InChIInChI=1S/C8H22N2OSi/c1-3-11-12(2)7-5-8(10)4-6-9/h8,12H,3-7,9-10H2,1-2H3
InChIKeyDHNTULVMEJFNCS-UHFFFAOYSA-N
XLogP0.44
TPSA61.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.36
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-[ethoxy(methyl)silyl]pentane-1,3-diamine?
The IUPAC name of 5-[ethoxy(methyl)silyl]pentane-1,3-diamine (CID 150032402) is 5-[ethoxy(methyl)silyl]pentane-1,3-diamine.
What is the SMILES notation for 5-[ethoxy(methyl)silyl]pentane-1,3-diamine?
The canonical SMILES for 5-[ethoxy(methyl)silyl]pentane-1,3-diamine is CCO[SiH](C)CCC(N)CCN.
What is the InChIKey of 5-[ethoxy(methyl)silyl]pentane-1,3-diamine?
The InChIKey is DHNTULVMEJFNCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H22N2OSi/c1-3-11-12(2)7-5-8(10)4-6-9/h8,12H,3-7,9-10H2,1-2H3.
What are the key properties of 5-[ethoxy(methyl)silyl]pentane-1,3-diamine?
5-[ethoxy(methyl)silyl]pentane-1,3-diamine has a molecular weight of 190.36 g/mol, XLogP of 0.44, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[ethoxy(methyl)silyl]pentane-1,3-diamine is sourced from PubChem (CID 150032402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).