(2R,3R)-6-(3-aminooxetan-3-yl)-2-[(2-methylpropan-2-yl)oxy]oxan-3-amine

C12H24N2O3 — CID 164844050

IUPAC(2R,3R)-6-(3-aminooxetan-3-yl)-2-[(2-methylpropan-2-yl)oxy]oxan-3-amine
SMILESCC(C)(C)O[C@H]1OC(C2(N)COC2)CC[C@H]1N
InChIInChI=1S/C12H24N2O3/c1-11(2,3)17-10-8(13)4-5-9(16-10)12(14)6-15-7-12/h8-10H,4-7,13-14H2,1-3H3/t8-,9?,10-/m1/s1
InChIKeyDDMXJMYGBSIHPS-RCAUJQPQSA-N
MW244.33 g/mol
LogP0.36
Rot. Bonds2

About (2R,3R)-6-(3-aminooxetan-3-yl)-2-[(2-methylpropan-2-yl)oxy]oxan-3-amine

(2R,3R)-6-(3-aminooxetan-3-yl)-2-[(2-methylpropan-2-yl)oxy]oxan-3-amine (PubChem CID 164844050) has the molecular formula C12H24N2O3 and a molecular weight of 244.33 g/mol. Its IUPAC name is (2R,3R)-6-(3-aminooxetan-3-yl)-2-[(2-methylpropan-2-yl)oxy]oxan-3-amine.

Molecular Properties

Compound Name(2R,3R)-6-(3-aminooxetan-3-yl)-2-[(2-methylpropan-2-yl)oxy]oxan-3-amine
PubChem CID164844050
Molecular FormulaC12H24N2O3
Molecular Weight244.33 g/mol
Exact Mass244.18
IUPAC Name(2R,3R)-6-(3-aminooxetan-3-yl)-2-[(2-methylpropan-2-yl)oxy]oxan-3-amine
SMILESCC(C)(C)O[C@H]1OC(C2(N)COC2)CC[C@H]1N
InChIInChI=1S/C12H24N2O3/c1-11(2,3)17-10-8(13)4-5-9(16-10)12(14)6-15-7-12/h8-10H,4-7,13-14H2,1-3H3/t8-,9?,10-/m1/s1
InChIKeyDDMXJMYGBSIHPS-RCAUJQPQSA-N
XLogP0.36
TPSA79.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.33
LogP ≤ 50.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze (2R,3R)-6-(3-aminooxetan-3-yl)-2-[(2-methylpropan-2-yl)oxy]oxan-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

7-[(2-methylpropan-2-yl)oxy]-2-oxaspiro[3.3]heptane
CID 166528165
2-[(2-methylpropan-2-yl)oxy]cyclohexan-1-amine;hydrochloride
CID 172642150
2-(bromomethyl)-3-[(2-methylpropan-2-yl)oxy]oxirane
CID 129043418
trans-(1R,2R)-1,2-bis[(2-methylpropan-2-yl)oxy]cyclobutane
CID 66800520
2-(aminomethyl)-6-[5-[3,5-diamino-2-[3-amino-6-(1-aminocyclopropyl)oxan-2-yl]oxy-6-hydroxycyclohexyl]oxy-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]oxy-5-methyloxane-3,4-diol
CID 167670235
(2S,3S,4R,5R)-2-(aminomethyl)-6-[(2R,3S,4R,5S)-5-[(1R,2R,3S,5R,6S)-3,5-diamino-2-[(2R,3R,6S)-3-amino-6-(1-aminocyclopropyl)oxan-2-yl]oxy-6-hydroxycyclohexyl]oxy-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]oxy-5-methyloxane-3,4-diol
CID 167670239
(2S,3R)-3-chloro-2-[(2-methylpropan-2-yl)oxy]oxane
CID 71399470
3-[[tert-butyl(dimethyl)silyl]oxymethyl]oxetan-3-amine
CID 171692296
(2R,3S,4S,5S,6S)-4-[bis(2-aminoethyl)amino]-2-methyl-6-[(2-methylpropan-2-yl)oxy]oxane-3,5-diol
CID 122629741
2-(2,2-dimethylpropyl)-3,4,5-trimethyl-6-[(2-methylpropan-2-yl)oxy]oxane
CID 121263512
2-[(2R,3S,4S,5S,6S)-3,5-dihydroxy-2-methyl-6-[(2-methylpropan-2-yl)oxy]oxan-4-yl]guanidine
CID 122629742
5-amino-2-(hydroxymethyl)-3-methyl-6-[(2-methylpropan-2-yl)oxy]oxan-4-ol
CID 155117279

Frequently Asked Questions

What is the IUPAC name of (2R,3R)-6-(3-aminooxetan-3-yl)-2-[(2-methylpropan-2-yl)oxy]oxan-3-amine?
The IUPAC name of (2R,3R)-6-(3-aminooxetan-3-yl)-2-[(2-methylpropan-2-yl)oxy]oxan-3-amine (CID 164844050) is (2R,3R)-6-(3-aminooxetan-3-yl)-2-[(2-methylpropan-2-yl)oxy]oxan-3-amine.
What is the SMILES notation for (2R,3R)-6-(3-aminooxetan-3-yl)-2-[(2-methylpropan-2-yl)oxy]oxan-3-amine?
The canonical SMILES for (2R,3R)-6-(3-aminooxetan-3-yl)-2-[(2-methylpropan-2-yl)oxy]oxan-3-amine is CC(C)(C)O[C@H]1OC(C2(N)COC2)CC[C@H]1N.
What is the InChIKey of (2R,3R)-6-(3-aminooxetan-3-yl)-2-[(2-methylpropan-2-yl)oxy]oxan-3-amine?
The InChIKey is DDMXJMYGBSIHPS-RCAUJQPQSA-N. The full InChI is InChI=1S/C12H24N2O3/c1-11(2,3)17-10-8(13)4-5-9(16-10)12(14)6-15-7-12/h8-10H,4-7,13-14H2,1-3H3/t8-,9?,10-/m1/s1.
What are the key properties of (2R,3R)-6-(3-aminooxetan-3-yl)-2-[(2-methylpropan-2-yl)oxy]oxan-3-amine?
(2R,3R)-6-(3-aminooxetan-3-yl)-2-[(2-methylpropan-2-yl)oxy]oxan-3-amine has a molecular weight of 244.33 g/mol, XLogP of 0.36, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R)-6-(3-aminooxetan-3-yl)-2-[(2-methylpropan-2-yl)oxy]oxan-3-amine is sourced from PubChem (CID 164844050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).