1-cyclododecyloxypropan-2-ol

C15H30O2 — CID 54403914

IUPAC1-cyclododecyloxypropan-2-ol
SMILESCC(O)COC1CCCCCCCCCCC1
InChIInChI=1S/C15H30O2/c1-14(16)13-17-15-11-9-7-5-3-2-4-6-8-10-12-15/h14-16H,2-13H2,1H3
InChIKeyVPILIYFTWHCTPQ-UHFFFAOYSA-N
MW242.40 g/mol
LogP4.06
Rot. Bonds3

About 1-cyclododecyloxypropan-2-ol

1-cyclododecyloxypropan-2-ol (PubChem CID 54403914) has the molecular formula C15H30O2 and a molecular weight of 242.40 g/mol. Its IUPAC name is 1-cyclododecyloxypropan-2-ol.

Molecular Properties

Compound Name1-cyclododecyloxypropan-2-ol
PubChem CID54403914
Molecular FormulaC15H30O2
Molecular Weight242.40 g/mol
Exact Mass242.22
IUPAC Name1-cyclododecyloxypropan-2-ol
SMILESCC(O)COC1CCCCCCCCCCC1
InChIInChI=1S/C15H30O2/c1-14(16)13-17-15-11-9-7-5-3-2-4-6-8-10-12-15/h14-16H,2-13H2,1H3
InChIKeyVPILIYFTWHCTPQ-UHFFFAOYSA-N
XLogP4.06
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.40
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(1-cyclohexyloxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropan-2-ol
CID 23372116
2-cycloheptyloxy-1-cyclopentylethanol
CID 104753667
(2R)-1-cyclohexyloxy-3-[(2-methylpropan-2-yl)oxy]propan-2-ol
CID 90381402
1-[4-(4-methylcyclohexyl)cyclohexyl]oxypropan-2-ol;1-methyl-4-[4-(2-methylpropoxy)cyclohexyl]cyclohexane
CID 54211881
1-[[(1S)-1-cycloheptylethyl]amino]-3-cyclopentyloxypropan-2-ol
CID 81391866
3-cyclopentyloxy-2-methylpropan-1-amine
CID 43367941
ethoxycyclopentane;methoxymethane;propane-1,2-diol
CID 66606332
3-cycloheptyloxy-2-methylpropanimidamide
CID 114995552
(2R)-1-cyclohexyloxy-3-[4-[(2R)-3-cyclohexyloxy-2-hydroxypropyl]piperazin-1-yl]propan-2-ol
CID 1120303
1-(1-cyclohexyloxypropan-2-yloxy)propan-2-yloxycyclohexane
CID 139806384
1-cyclohexyloxy-3-(4-methylpentylamino)propan-2-ol
CID 60743809
3-[(3-cyclohexyloxy-2-hydroxypropyl)amino]butan-1-ol
CID 83178126

Frequently Asked Questions

What is the IUPAC name of 1-cyclododecyloxypropan-2-ol?
The IUPAC name of 1-cyclododecyloxypropan-2-ol (CID 54403914) is 1-cyclododecyloxypropan-2-ol.
What is the SMILES notation for 1-cyclododecyloxypropan-2-ol?
The canonical SMILES for 1-cyclododecyloxypropan-2-ol is CC(O)COC1CCCCCCCCCCC1.
What is the InChIKey of 1-cyclododecyloxypropan-2-ol?
The InChIKey is VPILIYFTWHCTPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30O2/c1-14(16)13-17-15-11-9-7-5-3-2-4-6-8-10-12-15/h14-16H,2-13H2,1H3.
What are the key properties of 1-cyclododecyloxypropan-2-ol?
1-cyclododecyloxypropan-2-ol has a molecular weight of 242.40 g/mol, XLogP of 4.06, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclododecyloxypropan-2-ol is sourced from PubChem (CID 54403914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).