(2R)-1-cyclohexyloxy-3-[(2-methylpropan-2-yl)oxy]propan-2-ol

C13H26O3 — CID 90381402

IUPAC(2R)-1-cyclohexyloxy-3-[(2-methylpropan-2-yl)oxy]propan-2-ol
SMILESCC(C)(C)OC[C@H](O)COC1CCCCC1
InChIInChI=1S/C13H26O3/c1-13(2,3)16-10-11(14)9-15-12-7-5-4-6-8-12/h11-12,14H,4-10H2,1-3H3/t11-/m1/s1
InChIKeyVJGBISGQTAUHKA-LLVKDONJSA-N
MW230.35 g/mol
LogP2.51
Rot. Bonds5

About (2R)-1-cyclohexyloxy-3-[(2-methylpropan-2-yl)oxy]propan-2-ol

(2R)-1-cyclohexyloxy-3-[(2-methylpropan-2-yl)oxy]propan-2-ol (PubChem CID 90381402) has the molecular formula C13H26O3 and a molecular weight of 230.35 g/mol. Its IUPAC name is (2R)-1-cyclohexyloxy-3-[(2-methylpropan-2-yl)oxy]propan-2-ol.

Molecular Properties

Compound Name(2R)-1-cyclohexyloxy-3-[(2-methylpropan-2-yl)oxy]propan-2-ol
PubChem CID90381402
Molecular FormulaC13H26O3
Molecular Weight230.35 g/mol
Exact Mass230.19
IUPAC Name(2R)-1-cyclohexyloxy-3-[(2-methylpropan-2-yl)oxy]propan-2-ol
SMILESCC(C)(C)OC[C@H](O)COC1CCCCC1
InChIInChI=1S/C13H26O3/c1-13(2,3)16-10-11(14)9-15-12-7-5-4-6-8-12/h11-12,14H,4-10H2,1-3H3/t11-/m1/s1
InChIKeyVJGBISGQTAUHKA-LLVKDONJSA-N
XLogP2.51
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2R)-1-cyclohexyloxy-3-[(2-methylpropan-2-yl)oxy]propan-2-ol 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

(2S)-1-(cyclohexylamino)-3-[(2-methylpropan-2-yl)oxy]propan-2-ol
CID 8741576
(2S)-1-cyclopentyl-3-[(2-methylpropan-2-yl)oxy]propan-2-ol
CID 157185666
1-cyclododecyloxypropan-2-ol
CID 54403914
(2-methylpropan-2-yl)oxymethoxycyclohexane
CID 15032741
cyclohexyl-[(2R)-2-hydroxy-3-[(2-methylpropan-2-yl)oxy]propyl]azanium
CID 8741573
1-(cyclohexylmethylamino)-3-[(2-methylpropan-2-yl)oxy]propan-2-ol
CID 60633651
1-cyclohexyloxy-3-[(2-methylcyclopentyl)amino]propan-2-ol
CID 63278409
1-cyclohexyloxy-3-[(2-methoxy-2-methylpropyl)amino]propan-2-ol
CID 104760353
(Z)-but-2-enedioic acid;1-(tert-butylamino)-3-cyclooctyloxypropan-2-ol
CID 20840735
1-cyclobutyl-3-[(2-methylpropan-2-yl)oxy]propan-2-ol
CID 105100757
2-[(3-cyclohexyloxy-2-hydroxypropyl)amino]-2-methylpropanamide
CID 61218646
1-[(3-cyclopentyloxy-2-hydroxypropyl)amino]-4,4-dimethylpentan-2-ol
CID 107152057

Frequently Asked Questions

What is the IUPAC name of (2R)-1-cyclohexyloxy-3-[(2-methylpropan-2-yl)oxy]propan-2-ol?
The IUPAC name of (2R)-1-cyclohexyloxy-3-[(2-methylpropan-2-yl)oxy]propan-2-ol (CID 90381402) is (2R)-1-cyclohexyloxy-3-[(2-methylpropan-2-yl)oxy]propan-2-ol.
What is the SMILES notation for (2R)-1-cyclohexyloxy-3-[(2-methylpropan-2-yl)oxy]propan-2-ol?
The canonical SMILES for (2R)-1-cyclohexyloxy-3-[(2-methylpropan-2-yl)oxy]propan-2-ol is CC(C)(C)OC[C@H](O)COC1CCCCC1.
What is the InChIKey of (2R)-1-cyclohexyloxy-3-[(2-methylpropan-2-yl)oxy]propan-2-ol?
The InChIKey is VJGBISGQTAUHKA-LLVKDONJSA-N. The full InChI is InChI=1S/C13H26O3/c1-13(2,3)16-10-11(14)9-15-12-7-5-4-6-8-12/h11-12,14H,4-10H2,1-3H3/t11-/m1/s1.
What are the key properties of (2R)-1-cyclohexyloxy-3-[(2-methylpropan-2-yl)oxy]propan-2-ol?
(2R)-1-cyclohexyloxy-3-[(2-methylpropan-2-yl)oxy]propan-2-ol has a molecular weight of 230.35 g/mol, XLogP of 2.51, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-cyclohexyloxy-3-[(2-methylpropan-2-yl)oxy]propan-2-ol is sourced from PubChem (CID 90381402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).