3-[dimethoxy(methyl)silyl]-N,N-dipropylpropan-1-amine

C12H29NO2Si — CID 12655871

IUPAC3-[dimethoxy(methyl)silyl]-N,N-dipropylpropan-1-amine
SMILESCCCN(CCC)CCC[Si](C)(OC)OC
InChIInChI=1S/C12H29NO2Si/c1-6-9-13(10-7-2)11-8-12-16(5,14-3)15-4/h6-12H2,1-5H3
InChIKeySWFMEKYKNYKVQN-UHFFFAOYSA-N
MW247.45 g/mol
LogP2.86
Rot. Bonds10

About 3-[dimethoxy(methyl)silyl]-N,N-dipropylpropan-1-amine

3-[dimethoxy(methyl)silyl]-N,N-dipropylpropan-1-amine (PubChem CID 12655871) has the molecular formula C12H29NO2Si and a molecular weight of 247.45 g/mol. Its IUPAC name is 3-[dimethoxy(methyl)silyl]-N,N-dipropylpropan-1-amine.

Molecular Properties

Compound Name3-[dimethoxy(methyl)silyl]-N,N-dipropylpropan-1-amine
PubChem CID12655871
Molecular FormulaC12H29NO2Si
Molecular Weight247.45 g/mol
Exact Mass247.20
IUPAC Name3-[dimethoxy(methyl)silyl]-N,N-dipropylpropan-1-amine
SMILESCCCN(CCC)CCC[Si](C)(OC)OC
InChIInChI=1S/C12H29NO2Si/c1-6-9-13(10-7-2)11-8-12-16(5,14-3)15-4/h6-12H2,1-5H3
InChIKeySWFMEKYKNYKVQN-UHFFFAOYSA-N
XLogP2.86
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.45
LogP ≤ 52.86
H-Bond Donors ≤ 50
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 3-[dimethoxy(methyl)silyl]-N,N-dipropylpropan-1-amine?
The IUPAC name of 3-[dimethoxy(methyl)silyl]-N,N-dipropylpropan-1-amine (CID 12655871) is 3-[dimethoxy(methyl)silyl]-N,N-dipropylpropan-1-amine.
What is the SMILES notation for 3-[dimethoxy(methyl)silyl]-N,N-dipropylpropan-1-amine?
The canonical SMILES for 3-[dimethoxy(methyl)silyl]-N,N-dipropylpropan-1-amine is CCCN(CCC)CCC[Si](C)(OC)OC.
What is the InChIKey of 3-[dimethoxy(methyl)silyl]-N,N-dipropylpropan-1-amine?
The InChIKey is SWFMEKYKNYKVQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H29NO2Si/c1-6-9-13(10-7-2)11-8-12-16(5,14-3)15-4/h6-12H2,1-5H3.
What are the key properties of 3-[dimethoxy(methyl)silyl]-N,N-dipropylpropan-1-amine?
3-[dimethoxy(methyl)silyl]-N,N-dipropylpropan-1-amine has a molecular weight of 247.45 g/mol, XLogP of 2.86, 10 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[dimethoxy(methyl)silyl]-N,N-dipropylpropan-1-amine is sourced from PubChem (CID 12655871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).