1-[methoxy-methyl-(2-methylpropyl)silyl]oxypropane-1,1-diamine

C9H24N2O2Si — CID 87856826

IUPAC1-[methoxy-methyl-(2-methylpropyl)silyl]oxypropane-1,1-diamine
SMILESCCC(N)(N)O[Si](C)(CC(C)C)OC
InChIInChI=1S/C9H24N2O2Si/c1-6-9(10,11)13-14(5,12-4)7-8(2)3/h8H,6-7,10-11H2,1-5H3
InChIKeySVSGVNLFCVYWRB-UHFFFAOYSA-N
MW220.39 g/mol
LogP1.36
Rot. Bonds6

About 1-[methoxy-methyl-(2-methylpropyl)silyl]oxypropane-1,1-diamine

1-[methoxy-methyl-(2-methylpropyl)silyl]oxypropane-1,1-diamine (PubChem CID 87856826) has the molecular formula C9H24N2O2Si and a molecular weight of 220.39 g/mol. Its IUPAC name is 1-[methoxy-methyl-(2-methylpropyl)silyl]oxypropane-1,1-diamine.

Molecular Properties

Compound Name1-[methoxy-methyl-(2-methylpropyl)silyl]oxypropane-1,1-diamine
PubChem CID87856826
Molecular FormulaC9H24N2O2Si
Molecular Weight220.39 g/mol
Exact Mass220.16
IUPAC Name1-[methoxy-methyl-(2-methylpropyl)silyl]oxypropane-1,1-diamine
SMILESCCC(N)(N)O[Si](C)(CC(C)C)OC
InChIInChI=1S/C9H24N2O2Si/c1-6-9(10,11)13-14(5,12-4)7-8(2)3/h8H,6-7,10-11H2,1-5H3
InChIKeySVSGVNLFCVYWRB-UHFFFAOYSA-N
XLogP1.36
TPSA70.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.39
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-[methoxy-methyl-(2-methylpropyl)silyl]oxypropane-1,1-diamine?
The IUPAC name of 1-[methoxy-methyl-(2-methylpropyl)silyl]oxypropane-1,1-diamine (CID 87856826) is 1-[methoxy-methyl-(2-methylpropyl)silyl]oxypropane-1,1-diamine.
What is the SMILES notation for 1-[methoxy-methyl-(2-methylpropyl)silyl]oxypropane-1,1-diamine?
The canonical SMILES for 1-[methoxy-methyl-(2-methylpropyl)silyl]oxypropane-1,1-diamine is CCC(N)(N)O[Si](C)(CC(C)C)OC.
What is the InChIKey of 1-[methoxy-methyl-(2-methylpropyl)silyl]oxypropane-1,1-diamine?
The InChIKey is SVSGVNLFCVYWRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H24N2O2Si/c1-6-9(10,11)13-14(5,12-4)7-8(2)3/h8H,6-7,10-11H2,1-5H3.
What are the key properties of 1-[methoxy-methyl-(2-methylpropyl)silyl]oxypropane-1,1-diamine?
1-[methoxy-methyl-(2-methylpropyl)silyl]oxypropane-1,1-diamine has a molecular weight of 220.39 g/mol, XLogP of 1.36, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[methoxy-methyl-(2-methylpropyl)silyl]oxypropane-1,1-diamine is sourced from PubChem (CID 87856826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).