[3-[[[2-[tert-butyl(dimethyl)silyl]oxy-2-cyclopentylethyl]amino]methyl]oxetan-3-yl]methanol

C18H37NO3Si — CID 167809144

IUPAC[3-[[[2-[tert-butyl(dimethyl)silyl]oxy-2-cyclopentylethyl]amino]methyl]oxetan-3-yl]methanol
SMILESCC(C)(C)[Si](C)(C)OC(CNCC1(CO)COC1)C1CCCC1
InChIInChI=1S/C18H37NO3Si/c1-17(2,3)23(4,5)22-16(15-8-6-7-9-15)10-19-11-18(12-20)13-21-14-18/h15-16,19-20H,6-14H2,1-5H3
InChIKeyACJBFRDYUCZSKX-UHFFFAOYSA-N
MW343.58 g/mol
LogP3.17
Rot. Bonds8

About [3-[[[2-[tert-butyl(dimethyl)silyl]oxy-2-cyclopentylethyl]amino]methyl]oxetan-3-yl]methanol

[3-[[[2-[tert-butyl(dimethyl)silyl]oxy-2-cyclopentylethyl]amino]methyl]oxetan-3-yl]methanol (PubChem CID 167809144) has the molecular formula C18H37NO3Si and a molecular weight of 343.58 g/mol. Its IUPAC name is [3-[[[2-[tert-butyl(dimethyl)silyl]oxy-2-cyclopentylethyl]amino]methyl]oxetan-3-yl]methanol.

Molecular Properties

Compound Name[3-[[[2-[tert-butyl(dimethyl)silyl]oxy-2-cyclopentylethyl]amino]methyl]oxetan-3-yl]methanol
PubChem CID167809144
Molecular FormulaC18H37NO3Si
Molecular Weight343.58 g/mol
Exact Mass343.25
IUPAC Name[3-[[[2-[tert-butyl(dimethyl)silyl]oxy-2-cyclopentylethyl]amino]methyl]oxetan-3-yl]methanol
SMILESCC(C)(C)[Si](C)(C)OC(CNCC1(CO)COC1)C1CCCC1
InChIInChI=1S/C18H37NO3Si/c1-17(2,3)23(4,5)22-16(15-8-6-7-9-15)10-19-11-18(12-20)13-21-14-18/h15-16,19-20H,6-14H2,1-5H3
InChIKeyACJBFRDYUCZSKX-UHFFFAOYSA-N
XLogP3.17
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.58
LogP ≤ 53.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze [3-[[[2-[tert-butyl(dimethyl)silyl]oxy-2-cyclopentylethyl]amino]methyl]oxetan-3-yl]methanol with MolForge

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Related Compounds

2-[tert-butyl(dimethyl)silyl]oxy-2-cyclopropyl-N-[(4-methoxyphenyl)methyl]ethanamine
CID 174144243
methyl (E,5R)-5-[tert-butyl(dimethyl)silyl]oxy-5-cyclohexyl-3-methylpent-2-enoate
CID 134943935
(2S)-2-cyclohexyl-2-[[3-(hydroxymethyl)oxetan-3-yl]methylamino]propan-1-ol
CID 99815019
[3-[(2,2,4-trimethylpentylamino)methyl]oxetan-3-yl]methanol
CID 115249148
1,3-dihexoxypropan-2-yl 8-[[2-[tert-butyl(dimethyl)silyl]oxy-2-cyclohexylethyl]amino]octanoate
CID 176613721
[3-[[[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]amino]methyl]oxetan-3-yl]methanol
CID 115249172
1-[tert-butyl(dimethyl)silyl]oxy-1-cyclohexylpropan-2-ol
CID 166437528
2-[tert-butyl(dimethyl)silyl]oxy-3-cyclohexylpropan-1-ol
CID 19966072
(2R)-1-[(3S)-3-[tert-butyl(dimethyl)silyl]oxy-3-cyclohexylpropyl]-5-oxopyrrolidine-2-carboxylic acid
CID 91595253
[3-[(4-methylpentylamino)methyl]oxetan-3-yl]methanol
CID 115249052
tert-butyl (3R)-3-[1-[tert-butyl(dimethyl)silyl]oxy-3-hydroxypropyl]piperidine-1-carboxylate
CID 171613411
tert-butyl-(1-cyclopentylprop-2-ynoxy)-dimethylsilane
CID 14314323

Frequently Asked Questions

What is the IUPAC name of [3-[[[2-[tert-butyl(dimethyl)silyl]oxy-2-cyclopentylethyl]amino]methyl]oxetan-3-yl]methanol?
The IUPAC name of [3-[[[2-[tert-butyl(dimethyl)silyl]oxy-2-cyclopentylethyl]amino]methyl]oxetan-3-yl]methanol (CID 167809144) is [3-[[[2-[tert-butyl(dimethyl)silyl]oxy-2-cyclopentylethyl]amino]methyl]oxetan-3-yl]methanol.
What is the SMILES notation for [3-[[[2-[tert-butyl(dimethyl)silyl]oxy-2-cyclopentylethyl]amino]methyl]oxetan-3-yl]methanol?
The canonical SMILES for [3-[[[2-[tert-butyl(dimethyl)silyl]oxy-2-cyclopentylethyl]amino]methyl]oxetan-3-yl]methanol is CC(C)(C)[Si](C)(C)OC(CNCC1(CO)COC1)C1CCCC1.
What is the InChIKey of [3-[[[2-[tert-butyl(dimethyl)silyl]oxy-2-cyclopentylethyl]amino]methyl]oxetan-3-yl]methanol?
The InChIKey is ACJBFRDYUCZSKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H37NO3Si/c1-17(2,3)23(4,5)22-16(15-8-6-7-9-15)10-19-11-18(12-20)13-21-14-18/h15-16,19-20H,6-14H2,1-5H3.
What are the key properties of [3-[[[2-[tert-butyl(dimethyl)silyl]oxy-2-cyclopentylethyl]amino]methyl]oxetan-3-yl]methanol?
[3-[[[2-[tert-butyl(dimethyl)silyl]oxy-2-cyclopentylethyl]amino]methyl]oxetan-3-yl]methanol has a molecular weight of 343.58 g/mol, XLogP of 3.17, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[[[2-[tert-butyl(dimethyl)silyl]oxy-2-cyclopentylethyl]amino]methyl]oxetan-3-yl]methanol is sourced from PubChem (CID 167809144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).