1-N'-cyclopropylethane-1,1-diamine;trimethoxysilane

C8H22N2O3Si — CID 173015060

IUPAC1-N'-cyclopropylethane-1,1-diamine;trimethoxysilane
SMILESCC(N)NC1CC1.CO[SiH](OC)OC
InChIInChI=1S/C5H12N2.C3H10O3Si/c1-4(6)7-5-2-3-5;1-4-7(5-2)6-3/h4-5,7H,2-3,6H2,1H3;7H,1-3H3
InChIKeyJQYBZIOBTVJANE-UHFFFAOYSA-N
MW222.36 g/mol
LogP-0.31
Rot. Bonds5

About 1-N'-cyclopropylethane-1,1-diamine;trimethoxysilane

1-N'-cyclopropylethane-1,1-diamine;trimethoxysilane (PubChem CID 173015060) has the molecular formula C8H22N2O3Si and a molecular weight of 222.36 g/mol. Its IUPAC name is 1-N'-cyclopropylethane-1,1-diamine;trimethoxysilane.

Molecular Properties

Compound Name1-N'-cyclopropylethane-1,1-diamine;trimethoxysilane
PubChem CID173015060
Molecular FormulaC8H22N2O3Si
Molecular Weight222.36 g/mol
Exact Mass222.14
IUPAC Name1-N'-cyclopropylethane-1,1-diamine;trimethoxysilane
SMILESCC(N)NC1CC1.CO[SiH](OC)OC
InChIInChI=1S/C5H12N2.C3H10O3Si/c1-4(6)7-5-2-3-5;1-4-7(5-2)6-3/h4-5,7H,2-3,6H2,1H3;7H,1-3H3
InChIKeyJQYBZIOBTVJANE-UHFFFAOYSA-N
XLogP-0.31
TPSA65.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.36
LogP ≤ 5-0.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'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 1-N'-cyclopropylethane-1,1-diamine;trimethoxysilane?
The IUPAC name of 1-N'-cyclopropylethane-1,1-diamine;trimethoxysilane (CID 173015060) is 1-N'-cyclopropylethane-1,1-diamine;trimethoxysilane.
What is the SMILES notation for 1-N'-cyclopropylethane-1,1-diamine;trimethoxysilane?
The canonical SMILES for 1-N'-cyclopropylethane-1,1-diamine;trimethoxysilane is CC(N)NC1CC1.CO[SiH](OC)OC.
What is the InChIKey of 1-N'-cyclopropylethane-1,1-diamine;trimethoxysilane?
The InChIKey is JQYBZIOBTVJANE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2.C3H10O3Si/c1-4(6)7-5-2-3-5;1-4-7(5-2)6-3/h4-5,7H,2-3,6H2,1H3;7H,1-3H3.
What are the key properties of 1-N'-cyclopropylethane-1,1-diamine;trimethoxysilane?
1-N'-cyclopropylethane-1,1-diamine;trimethoxysilane has a molecular weight of 222.36 g/mol, XLogP of -0.31, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N'-cyclopropylethane-1,1-diamine;trimethoxysilane is sourced from PubChem (CID 173015060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).