1-[2-(oxan-2-yl)ethyl]-2-propylcyclopropan-1-ol

C13H24O2 — CID 79332139

IUPAC1-[2-(oxan-2-yl)ethyl]-2-propylcyclopropan-1-ol
SMILESCCCC1CC1(O)CCC1CCCCO1
InChIInChI=1S/C13H24O2/c1-2-5-11-10-13(11,14)8-7-12-6-3-4-9-15-12/h11-12,14H,2-10H2,1H3
InChIKeyZJDUXFPIFZIVEP-UHFFFAOYSA-N
MW212.33 g/mol
LogP2.89
Rot. Bonds5

About 1-[2-(oxan-2-yl)ethyl]-2-propylcyclopropan-1-ol

1-[2-(oxan-2-yl)ethyl]-2-propylcyclopropan-1-ol (PubChem CID 79332139) has the molecular formula C13H24O2 and a molecular weight of 212.33 g/mol. Its IUPAC name is 1-[2-(oxan-2-yl)ethyl]-2-propylcyclopropan-1-ol.

Molecular Properties

Compound Name1-[2-(oxan-2-yl)ethyl]-2-propylcyclopropan-1-ol
PubChem CID79332139
Molecular FormulaC13H24O2
Molecular Weight212.33 g/mol
Exact Mass212.18
IUPAC Name1-[2-(oxan-2-yl)ethyl]-2-propylcyclopropan-1-ol
SMILESCCCC1CC1(O)CCC1CCCCO1
InChIInChI=1S/C13H24O2/c1-2-5-11-10-13(11,14)8-7-12-6-3-4-9-15-12/h11-12,14H,2-10H2,1H3
InChIKeyZJDUXFPIFZIVEP-UHFFFAOYSA-N
XLogP2.89
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.33
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-(oxan-2-yl)ethyl]cyclobutan-1-ol
CID 115073640
2-methyl-1-[2-(oxolan-2-yl)ethyl]cyclobutan-1-ol
CID 130554995
1-[2-(oxolan-2-yl)ethyl]cyclopentan-1-ol
CID 65162273
1-[2-(oxolan-2-yl)ethyl]cycloheptan-1-ol
CID 65162275
1-(2-methoxyethyl)-2-propylcyclopropan-1-ol
CID 79333654
2,2-dimethyl-1-[2-(oxolan-2-yl)ethyl]cyclohexan-1-ol
CID 79847009
1-(3-methylbutyl)-2-propylcyclopropan-1-ol
CID 79332942
5-methyl-3-[2-(oxolan-2-yl)ethyl]oxolan-3-ol
CID 164644045
2-[3-(oxan-2-yl)propyl]oxane
CID 71182925
6-[2-(oxolan-2-yl)ethyl]bicyclo[3.1.0]hexan-6-ol
CID 79331777
4-methyl-1-[2-(oxolan-2-yl)ethyl]cycloheptan-1-ol
CID 65166935
ethanol;oxan-2-ylmethanol
CID 66900182

Frequently Asked Questions

What is the IUPAC name of 1-[2-(oxan-2-yl)ethyl]-2-propylcyclopropan-1-ol?
The IUPAC name of 1-[2-(oxan-2-yl)ethyl]-2-propylcyclopropan-1-ol (CID 79332139) is 1-[2-(oxan-2-yl)ethyl]-2-propylcyclopropan-1-ol.
What is the SMILES notation for 1-[2-(oxan-2-yl)ethyl]-2-propylcyclopropan-1-ol?
The canonical SMILES for 1-[2-(oxan-2-yl)ethyl]-2-propylcyclopropan-1-ol is CCCC1CC1(O)CCC1CCCCO1.
What is the InChIKey of 1-[2-(oxan-2-yl)ethyl]-2-propylcyclopropan-1-ol?
The InChIKey is ZJDUXFPIFZIVEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24O2/c1-2-5-11-10-13(11,14)8-7-12-6-3-4-9-15-12/h11-12,14H,2-10H2,1H3.
What are the key properties of 1-[2-(oxan-2-yl)ethyl]-2-propylcyclopropan-1-ol?
1-[2-(oxan-2-yl)ethyl]-2-propylcyclopropan-1-ol has a molecular weight of 212.33 g/mol, XLogP of 2.89, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(oxan-2-yl)ethyl]-2-propylcyclopropan-1-ol is sourced from PubChem (CID 79332139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).