1-[tert-butyl(dimethyl)silyl]oxy-3-[methyl(prop-2-enyl)amino]-2-[[methyl(prop-2-enyl)amino]methyl]propan-2-ol

C18H38N2O2Si — CID 135019808

IUPAC1-[tert-butyl(dimethyl)silyl]oxy-3-[methyl(prop-2-enyl)amino]-2-[[methyl(prop-2-enyl)amino]methyl]propan-2-ol
SMILESC=CCN(C)CC(O)(CO[Si](C)(C)C(C)(C)C)CN(C)CC=C
InChIInChI=1S/C18H38N2O2Si/c1-10-12-19(6)14-18(21,15-20(7)13-11-2)16-22-23(8,9)17(3,4)5/h10-11,21H,1-2,12-16H2,3-9H3
InChIKeyMWAZQFMFDPYJKB-UHFFFAOYSA-N
MW342.60 g/mol
LogP2.97
Rot. Bonds11

About 1-[tert-butyl(dimethyl)silyl]oxy-3-[methyl(prop-2-enyl)amino]-2-[[methyl(prop-2-enyl)amino]methyl]propan-2-ol

1-[tert-butyl(dimethyl)silyl]oxy-3-[methyl(prop-2-enyl)amino]-2-[[methyl(prop-2-enyl)amino]methyl]propan-2-ol (PubChem CID 135019808) has the molecular formula C18H38N2O2Si and a molecular weight of 342.60 g/mol. Its IUPAC name is 1-[tert-butyl(dimethyl)silyl]oxy-3-[methyl(prop-2-enyl)amino]-2-[[methyl(prop-2-enyl)amino]methyl]propan-2-ol.

Molecular Properties

Compound Name1-[tert-butyl(dimethyl)silyl]oxy-3-[methyl(prop-2-enyl)amino]-2-[[methyl(prop-2-enyl)amino]methyl]propan-2-ol
PubChem CID135019808
Molecular FormulaC18H38N2O2Si
Molecular Weight342.60 g/mol
Exact Mass342.27
IUPAC Name1-[tert-butyl(dimethyl)silyl]oxy-3-[methyl(prop-2-enyl)amino]-2-[[methyl(prop-2-enyl)amino]methyl]propan-2-ol
SMILESC=CCN(C)CC(O)(CO[Si](C)(C)C(C)(C)C)CN(C)CC=C
InChIInChI=1S/C18H38N2O2Si/c1-10-12-19(6)14-18(21,15-20(7)13-11-2)16-22-23(8,9)17(3,4)5/h10-11,21H,1-2,12-16H2,3-9H3
InChIKeyMWAZQFMFDPYJKB-UHFFFAOYSA-N
XLogP2.97
TPSA35.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.60
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-[tert-butyl(dimethyl)silyl]oxy-3-[methyl(prop-2-ynyl)amino]-2-[[methyl(prop-2-ynyl)amino]methyl]propan-2-ol
CID 135019809
tert-butyl-dimethyl-prop-2-enoxysilane;trimethyl(prop-2-enoxy)silane
CID 87853444
(NE)-N-[3-[tert-butyl(dimethyl)silyl]oxy-2,2-dimethylpropylidene]hydroxylamine
CID 121006548
(2R)-1-[tert-butyl(dimethyl)silyl]oxy-2-(oxan-2-yloxymethyl)pent-4-en-2-ol
CID 11121088
(2S)-1-[tert-butyl(dimethyl)silyl]oxypent-4-en-2-ol
CID 11148647
(E)-5-[tert-butyl(dimethyl)silyl]oxy-4,4-dimethylpent-2-enenitrile
CID 101169649
1-[tert-butyl(dimethyl)silyl]oxy-2-methylbut-3-yn-2-ol
CID 11095976
tert-butyl-dimethyl-(2-methylidenebut-3-enoxy)silane
CID 10058581
tert-butyl-(2,2-difluoropropoxy)-dimethylsilane
CID 123170783
N-methyl-N-prop-2-enylprop-2-en-1-amine;hydroiodide
CID 141311417
tert-butyl-dimethyl-octadec-17-enoxysilane
CID 24879926
3-[tert-butyl(dimethyl)silyl]oxy-2,2-dimethylpropane-1,1-diol
CID 123722416

Frequently Asked Questions

What is the IUPAC name of 1-[tert-butyl(dimethyl)silyl]oxy-3-[methyl(prop-2-enyl)amino]-2-[[methyl(prop-2-enyl)amino]methyl]propan-2-ol?
The IUPAC name of 1-[tert-butyl(dimethyl)silyl]oxy-3-[methyl(prop-2-enyl)amino]-2-[[methyl(prop-2-enyl)amino]methyl]propan-2-ol (CID 135019808) is 1-[tert-butyl(dimethyl)silyl]oxy-3-[methyl(prop-2-enyl)amino]-2-[[methyl(prop-2-enyl)amino]methyl]propan-2-ol.
What is the SMILES notation for 1-[tert-butyl(dimethyl)silyl]oxy-3-[methyl(prop-2-enyl)amino]-2-[[methyl(prop-2-enyl)amino]methyl]propan-2-ol?
The canonical SMILES for 1-[tert-butyl(dimethyl)silyl]oxy-3-[methyl(prop-2-enyl)amino]-2-[[methyl(prop-2-enyl)amino]methyl]propan-2-ol is C=CCN(C)CC(O)(CO[Si](C)(C)C(C)(C)C)CN(C)CC=C.
What is the InChIKey of 1-[tert-butyl(dimethyl)silyl]oxy-3-[methyl(prop-2-enyl)amino]-2-[[methyl(prop-2-enyl)amino]methyl]propan-2-ol?
The InChIKey is MWAZQFMFDPYJKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H38N2O2Si/c1-10-12-19(6)14-18(21,15-20(7)13-11-2)16-22-23(8,9)17(3,4)5/h10-11,21H,1-2,12-16H2,3-9H3.
What are the key properties of 1-[tert-butyl(dimethyl)silyl]oxy-3-[methyl(prop-2-enyl)amino]-2-[[methyl(prop-2-enyl)amino]methyl]propan-2-ol?
1-[tert-butyl(dimethyl)silyl]oxy-3-[methyl(prop-2-enyl)amino]-2-[[methyl(prop-2-enyl)amino]methyl]propan-2-ol has a molecular weight of 342.60 g/mol, XLogP of 2.97, 11 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[tert-butyl(dimethyl)silyl]oxy-3-[methyl(prop-2-enyl)amino]-2-[[methyl(prop-2-enyl)amino]methyl]propan-2-ol is sourced from PubChem (CID 135019808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).