3-[methyl-bis[(2-methylpropan-2-yl)oxy]silyl]propan-1-amine

C12H29NO2Si — CID 139759530

IUPAC3-[methyl-bis[(2-methylpropan-2-yl)oxy]silyl]propan-1-amine
SMILESCC(C)(C)O[Si](C)(CCCN)OC(C)(C)C
InChIInChI=1S/C12H29NO2Si/c1-11(2,3)14-16(7,10-8-9-13)15-12(4,5)6/h8-10,13H2,1-7H3
InChIKeyJPWRHAPUBMQFRC-UHFFFAOYSA-N
MW247.45 g/mol
LogP3.04
Rot. Bonds5

About 3-[methyl-bis[(2-methylpropan-2-yl)oxy]silyl]propan-1-amine

3-[methyl-bis[(2-methylpropan-2-yl)oxy]silyl]propan-1-amine (PubChem CID 139759530) has the molecular formula C12H29NO2Si and a molecular weight of 247.45 g/mol. Its IUPAC name is 3-[methyl-bis[(2-methylpropan-2-yl)oxy]silyl]propan-1-amine.

Molecular Properties

Compound Name3-[methyl-bis[(2-methylpropan-2-yl)oxy]silyl]propan-1-amine
PubChem CID139759530
Molecular FormulaC12H29NO2Si
Molecular Weight247.45 g/mol
Exact Mass247.20
IUPAC Name3-[methyl-bis[(2-methylpropan-2-yl)oxy]silyl]propan-1-amine
SMILESCC(C)(C)O[Si](C)(CCCN)OC(C)(C)C
InChIInChI=1S/C12H29NO2Si/c1-11(2,3)14-16(7,10-8-9-13)15-12(4,5)6/h8-10,13H2,1-7H3
InChIKeyJPWRHAPUBMQFRC-UHFFFAOYSA-N
XLogP3.04
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.45
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-[methyl-bis[(2-methylpropan-2-yl)oxy]silyl]propane-1-thiol
CID 139759526
butyl-methoxy-methyl-[(2-methylpropan-2-yl)oxy]silane
CID 139614116
3-[[2-(3-aminopropyl-ethoxy-methylsilyl)oxy-2-methylpropyl]-ethoxy-methylsilyl]propan-1-amine
CID 59502140
2-aminoacetaldehyde;3-[diethoxy-[(2-methylpropan-2-yl)oxy]silyl]propan-1-amine
CID 87438219
methyl-bis[(2-methylpropan-2-yl)oxy]-[3-(oxiran-2-ylmethoxy)propyl]silane
CID 139759531
3-[methyl-(methyl-propyl-trimethylsilyloxysilyl)oxy-trimethylsilyloxysilyl]propan-1-amine
CID 123147792
3-[methoxy(dimethyl)silyl]propan-1-amine
CID 2733753
3-[diethoxy(methyl)silyl]propan-1-amine;tetramethyl silicate
CID 160657571
4-[[3-aminopropyl(dimethyl)silyl]methoxy]-4-methylpentan-1-amine
CID 59979890
methoxy-methyl-[(2-methylpropan-2-yl)oxy]-(3-prop-1-enoxypropyl)silane
CID 141299750
3-[[[[[[3-aminopropyl(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propan-1-amine
CID 18354066
3-(3-aminopropyl-ethoxy-methylsilyl)propan-1-amine
CID 87400628

Frequently Asked Questions

What is the IUPAC name of 3-[methyl-bis[(2-methylpropan-2-yl)oxy]silyl]propan-1-amine?
The IUPAC name of 3-[methyl-bis[(2-methylpropan-2-yl)oxy]silyl]propan-1-amine (CID 139759530) is 3-[methyl-bis[(2-methylpropan-2-yl)oxy]silyl]propan-1-amine.
What is the SMILES notation for 3-[methyl-bis[(2-methylpropan-2-yl)oxy]silyl]propan-1-amine?
The canonical SMILES for 3-[methyl-bis[(2-methylpropan-2-yl)oxy]silyl]propan-1-amine is CC(C)(C)O[Si](C)(CCCN)OC(C)(C)C.
What is the InChIKey of 3-[methyl-bis[(2-methylpropan-2-yl)oxy]silyl]propan-1-amine?
The InChIKey is JPWRHAPUBMQFRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H29NO2Si/c1-11(2,3)14-16(7,10-8-9-13)15-12(4,5)6/h8-10,13H2,1-7H3.
What are the key properties of 3-[methyl-bis[(2-methylpropan-2-yl)oxy]silyl]propan-1-amine?
3-[methyl-bis[(2-methylpropan-2-yl)oxy]silyl]propan-1-amine has a molecular weight of 247.45 g/mol, XLogP of 3.04, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[methyl-bis[(2-methylpropan-2-yl)oxy]silyl]propan-1-amine is sourced from PubChem (CID 139759530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).