3-(2-methoxy-1,3,6,2-trioxasilocan-2-yl)-N,N-dimethylpropan-1-amine

C10H23NO4Si — CID 151097088

IUPAC3-(2-methoxy-1,3,6,2-trioxasilocan-2-yl)-N,N-dimethylpropan-1-amine
SMILESCO[Si]1(CCCN(C)C)OCCOCCO1
InChIInChI=1S/C10H23NO4Si/c1-11(2)5-4-10-16(12-3)14-8-6-13-7-9-15-16/h4-10H2,1-3H3
InChIKeyMNILAKHKELIHRJ-UHFFFAOYSA-N
MW249.38 g/mol
LogP0.59
Rot. Bonds5

About 3-(2-methoxy-1,3,6,2-trioxasilocan-2-yl)-N,N-dimethylpropan-1-amine

3-(2-methoxy-1,3,6,2-trioxasilocan-2-yl)-N,N-dimethylpropan-1-amine (PubChem CID 151097088) has the molecular formula C10H23NO4Si and a molecular weight of 249.38 g/mol. Its IUPAC name is 3-(2-methoxy-1,3,6,2-trioxasilocan-2-yl)-N,N-dimethylpropan-1-amine.

Molecular Properties

Compound Name3-(2-methoxy-1,3,6,2-trioxasilocan-2-yl)-N,N-dimethylpropan-1-amine
PubChem CID151097088
Molecular FormulaC10H23NO4Si
Molecular Weight249.38 g/mol
Exact Mass249.14
IUPAC Name3-(2-methoxy-1,3,6,2-trioxasilocan-2-yl)-N,N-dimethylpropan-1-amine
SMILESCO[Si]1(CCCN(C)C)OCCOCCO1
InChIInChI=1S/C10H23NO4Si/c1-11(2)5-4-10-16(12-3)14-8-6-13-7-9-15-16/h4-10H2,1-3H3
InChIKeyMNILAKHKELIHRJ-UHFFFAOYSA-N
XLogP0.59
TPSA40.16 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.38
LogP ≤ 50.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N,N-dimethyl-3-(2,5,5-trimethyl-1,3,2-dioxasilinan-2-yl)propan-1-amine
CID 156755610
N,N,N',N'-tetramethylbutane-1,4-diamine;dihydrochloride
CID 20545505
1,2-dimethoxyethane;1,4,7,10,13,16-hexaoxacyclooctadecane
CID 87702464
1,4-dioxane;trimethoxymethane
CID 18379719
N',N'-dimethyl-N-(2-morpholin-4-ylethyl)propane-1,3-diamine
CID 28583738
N,N,N',N'-tetramethylpentane-1,5-diamine;dihydrobromide
CID 173097999
N,N-dibutylbutan-1-amine;1,4-dioxane
CID 67854629
17,18-dimethoxy-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(19),15,17-triene
CID 5251455
3-(hydroxy-methoxy-methylsilyl)-N,N-dimethylpropan-1-amine
CID 172523443
3-(2-methoxy-2-methylazasilolidin-1-yl)-N,N-dimethylpropan-1-amine
CID 140722643
CID 54031697
CID 54031697
N-[3-(dimethylamino)propyl]morpholine-4-carboxamide
CID 3255795

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxy-1,3,6,2-trioxasilocan-2-yl)-N,N-dimethylpropan-1-amine?
The IUPAC name of 3-(2-methoxy-1,3,6,2-trioxasilocan-2-yl)-N,N-dimethylpropan-1-amine (CID 151097088) is 3-(2-methoxy-1,3,6,2-trioxasilocan-2-yl)-N,N-dimethylpropan-1-amine.
What is the SMILES notation for 3-(2-methoxy-1,3,6,2-trioxasilocan-2-yl)-N,N-dimethylpropan-1-amine?
The canonical SMILES for 3-(2-methoxy-1,3,6,2-trioxasilocan-2-yl)-N,N-dimethylpropan-1-amine is CO[Si]1(CCCN(C)C)OCCOCCO1.
What is the InChIKey of 3-(2-methoxy-1,3,6,2-trioxasilocan-2-yl)-N,N-dimethylpropan-1-amine?
The InChIKey is MNILAKHKELIHRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO4Si/c1-11(2)5-4-10-16(12-3)14-8-6-13-7-9-15-16/h4-10H2,1-3H3.
What are the key properties of 3-(2-methoxy-1,3,6,2-trioxasilocan-2-yl)-N,N-dimethylpropan-1-amine?
3-(2-methoxy-1,3,6,2-trioxasilocan-2-yl)-N,N-dimethylpropan-1-amine has a molecular weight of 249.38 g/mol, XLogP of 0.59, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxy-1,3,6,2-trioxasilocan-2-yl)-N,N-dimethylpropan-1-amine is sourced from PubChem (CID 151097088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).