2-propoxy-3-(3,3,3-trifluoropropoxy)cyclobutan-1-ol

C10H17F3O3 — CID 107942629

IUPAC2-propoxy-3-(3,3,3-trifluoropropoxy)cyclobutan-1-ol
SMILESCCCOC1C(O)CC1OCCC(F)(F)F
InChIInChI=1S/C10H17F3O3/c1-2-4-16-9-7(14)6-8(9)15-5-3-10(11,12)13/h7-9,14H,2-6H2,1H3
InChIKeySCVIPQSRISCEAM-UHFFFAOYSA-N
MW242.24 g/mol
LogP1.88
Rot. Bonds6

About 2-propoxy-3-(3,3,3-trifluoropropoxy)cyclobutan-1-ol

2-propoxy-3-(3,3,3-trifluoropropoxy)cyclobutan-1-ol (PubChem CID 107942629) has the molecular formula C10H17F3O3 and a molecular weight of 242.24 g/mol. Its IUPAC name is 2-propoxy-3-(3,3,3-trifluoropropoxy)cyclobutan-1-ol.

Molecular Properties

Compound Name2-propoxy-3-(3,3,3-trifluoropropoxy)cyclobutan-1-ol
PubChem CID107942629
Molecular FormulaC10H17F3O3
Molecular Weight242.24 g/mol
Exact Mass242.11
IUPAC Name2-propoxy-3-(3,3,3-trifluoropropoxy)cyclobutan-1-ol
SMILESCCCOC1C(O)CC1OCCC(F)(F)F
InChIInChI=1S/C10H17F3O3/c1-2-4-16-9-7(14)6-8(9)15-5-3-10(11,12)13/h7-9,14H,2-6H2,1H3
InChIKeySCVIPQSRISCEAM-UHFFFAOYSA-N
XLogP1.88
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.24
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-propoxy-3-(3,3,3-trifluoropropoxy)cyclobutan-1-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

2-propoxy-3-(2-propoxyethoxy)cyclobutan-1-ol
CID 107942594
3-(2,2-difluoroethoxy)-2-propoxycyclobutan-1-ol
CID 107942627
4-propyl-2-(3,3,3-trifluoropropoxy)cyclohexan-1-ol
CID 82957761
3-[(2-methylpropan-2-yl)oxy]-2-propoxycyclobutan-1-ol
CID 107942520
2-propoxycyclopropan-1-ol
CID 174614862
3-(2-butoxyethoxy)-2-ethoxycyclobutan-1-ol
CID 104675355
2-propoxy-3-[2-(trifluoromethyl)phenoxy]cyclobutan-1-ol
CID 107942467
3-(3-methylbutan-2-yloxy)-2-propoxycyclobutan-1-ol
CID 107942618
3-(2-cyclopropylethoxy)-2-ethoxycyclobutan-1-ol
CID 106207193
3-(4-bromophenoxy)-2-propoxycyclobutan-1-ol
CID 114018846
3-(3,5-difluorophenoxy)-2-propoxycyclobutan-1-ol
CID 107942588
3-cyclohexyloxy-2-propoxycyclobutan-1-ol
CID 107942480

Frequently Asked Questions

What is the IUPAC name of 2-propoxy-3-(3,3,3-trifluoropropoxy)cyclobutan-1-ol?
The IUPAC name of 2-propoxy-3-(3,3,3-trifluoropropoxy)cyclobutan-1-ol (CID 107942629) is 2-propoxy-3-(3,3,3-trifluoropropoxy)cyclobutan-1-ol.
What is the SMILES notation for 2-propoxy-3-(3,3,3-trifluoropropoxy)cyclobutan-1-ol?
The canonical SMILES for 2-propoxy-3-(3,3,3-trifluoropropoxy)cyclobutan-1-ol is CCCOC1C(O)CC1OCCC(F)(F)F.
What is the InChIKey of 2-propoxy-3-(3,3,3-trifluoropropoxy)cyclobutan-1-ol?
The InChIKey is SCVIPQSRISCEAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F3O3/c1-2-4-16-9-7(14)6-8(9)15-5-3-10(11,12)13/h7-9,14H,2-6H2,1H3.
What are the key properties of 2-propoxy-3-(3,3,3-trifluoropropoxy)cyclobutan-1-ol?
2-propoxy-3-(3,3,3-trifluoropropoxy)cyclobutan-1-ol has a molecular weight of 242.24 g/mol, XLogP of 1.88, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propoxy-3-(3,3,3-trifluoropropoxy)cyclobutan-1-ol is sourced from PubChem (CID 107942629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).