3-[ethoxy(dimethyl)silyl]-N,N-dipropylpropan-1-amine

C13H31NOSi — CID 87204397

IUPAC3-[ethoxy(dimethyl)silyl]-N,N-dipropylpropan-1-amine
SMILESCCCN(CCC)CCC[Si](C)(C)OCC
InChIInChI=1S/C13H31NOSi/c1-6-10-14(11-7-2)12-9-13-16(4,5)15-8-3/h6-13H2,1-5H3
InChIKeyURWZAYNFHNPVLO-UHFFFAOYSA-N
MW245.48 g/mol
LogP3.74
Rot. Bonds10

About 3-[ethoxy(dimethyl)silyl]-N,N-dipropylpropan-1-amine

3-[ethoxy(dimethyl)silyl]-N,N-dipropylpropan-1-amine (PubChem CID 87204397) has the molecular formula C13H31NOSi and a molecular weight of 245.48 g/mol. Its IUPAC name is 3-[ethoxy(dimethyl)silyl]-N,N-dipropylpropan-1-amine.

Molecular Properties

Compound Name3-[ethoxy(dimethyl)silyl]-N,N-dipropylpropan-1-amine
PubChem CID87204397
Molecular FormulaC13H31NOSi
Molecular Weight245.48 g/mol
Exact Mass245.22
IUPAC Name3-[ethoxy(dimethyl)silyl]-N,N-dipropylpropan-1-amine
SMILESCCCN(CCC)CCC[Si](C)(C)OCC
InChIInChI=1S/C13H31NOSi/c1-6-10-14(11-7-2)12-9-13-16(4,5)15-8-3/h6-13H2,1-5H3
InChIKeyURWZAYNFHNPVLO-UHFFFAOYSA-N
XLogP3.74
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.48
LogP ≤ 53.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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-[ethoxy(dimethyl)silyl]-N,N-dipropylpropan-1-amine?
The IUPAC name of 3-[ethoxy(dimethyl)silyl]-N,N-dipropylpropan-1-amine (CID 87204397) is 3-[ethoxy(dimethyl)silyl]-N,N-dipropylpropan-1-amine.
What is the SMILES notation for 3-[ethoxy(dimethyl)silyl]-N,N-dipropylpropan-1-amine?
The canonical SMILES for 3-[ethoxy(dimethyl)silyl]-N,N-dipropylpropan-1-amine is CCCN(CCC)CCC[Si](C)(C)OCC.
What is the InChIKey of 3-[ethoxy(dimethyl)silyl]-N,N-dipropylpropan-1-amine?
The InChIKey is URWZAYNFHNPVLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H31NOSi/c1-6-10-14(11-7-2)12-9-13-16(4,5)15-8-3/h6-13H2,1-5H3.
What are the key properties of 3-[ethoxy(dimethyl)silyl]-N,N-dipropylpropan-1-amine?
3-[ethoxy(dimethyl)silyl]-N,N-dipropylpropan-1-amine has a molecular weight of 245.48 g/mol, XLogP of 3.74, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[ethoxy(dimethyl)silyl]-N,N-dipropylpropan-1-amine is sourced from PubChem (CID 87204397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).