3-(cycloocten-1-yl)-1-cyclopropylpyrrolidin-3-ol

C15H25NO — CID 106650887

IUPAC3-(cycloocten-1-yl)-1-cyclopropylpyrrolidin-3-ol
SMILESOC1(C2=CCCCCCC2)CCN(C2CC2)C1
InChIInChI=1S/C15H25NO/c17-15(10-11-16(12-15)14-8-9-14)13-6-4-2-1-3-5-7-13/h6,14,17H,1-5,7-12H2
InChIKeyWNRKIRKDGZWNRA-UHFFFAOYSA-N
MW235.37 g/mol
LogP2.87
Rot. Bonds2

About 3-(cycloocten-1-yl)-1-cyclopropylpyrrolidin-3-ol

3-(cycloocten-1-yl)-1-cyclopropylpyrrolidin-3-ol (PubChem CID 106650887) has the molecular formula C15H25NO and a molecular weight of 235.37 g/mol. Its IUPAC name is 3-(cycloocten-1-yl)-1-cyclopropylpyrrolidin-3-ol.

Molecular Properties

Compound Name3-(cycloocten-1-yl)-1-cyclopropylpyrrolidin-3-ol
PubChem CID106650887
Molecular FormulaC15H25NO
Molecular Weight235.37 g/mol
Exact Mass235.19
IUPAC Name3-(cycloocten-1-yl)-1-cyclopropylpyrrolidin-3-ol
SMILESOC1(C2=CCCCCCC2)CCN(C2CC2)C1
InChIInChI=1S/C15H25NO/c17-15(10-11-16(12-15)14-8-9-14)13-6-4-2-1-3-5-7-13/h6,14,17H,1-5,7-12H2
InChIKeyWNRKIRKDGZWNRA-UHFFFAOYSA-N
XLogP2.87
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

1-(2-methylprop-1-enyl)-3,5,6,7,8,8a-hexahydro-2H-indolizin-1-ol
CID 81886676
2-[(1R,6R)-9-methyl-9-azabicyclo[4.2.1]non-2-en-2-yl]propan-2-ol
CID 101613769
3-(Cycloocten-1-yl)-1-methylpyrrolidin-3-ol
CID 106650884
3-(Cyclohexen-1-yl)-1-methylpyrrolidin-3-ol
CID 106650885
3-(Cyclohepten-1-yl)-1-methylpyrrolidin-3-ol
CID 106650886
3-(Cyclohexen-1-yl)-1-cyclopropylpyrrolidin-3-ol
CID 106650888
3-(Cyclohepten-1-yl)-1-cyclopropylpyrrolidin-3-ol
CID 106650889
3-(Cycloocten-1-yl)pyrrolidin-3-ol
CID 106650909
3-(Cycloocten-1-yl)-1,5-dimethylpyrrolidin-3-ol
CID 106651396
3-(Cyclohexen-1-yl)-1,5-dimethylpyrrolidin-3-ol
CID 106651397
3-(Cyclohepten-1-yl)-1,5-dimethylpyrrolidin-3-ol
CID 106651398
7-(cycloocten-1-yl)-2,3,5,6,8,8a-hexahydro-1H-indolizin-7-ol
CID 106651406

Frequently Asked Questions

What is the IUPAC name of 3-(cycloocten-1-yl)-1-cyclopropylpyrrolidin-3-ol?
The IUPAC name of 3-(cycloocten-1-yl)-1-cyclopropylpyrrolidin-3-ol (CID 106650887) is 3-(cycloocten-1-yl)-1-cyclopropylpyrrolidin-3-ol.
What is the SMILES notation for 3-(cycloocten-1-yl)-1-cyclopropylpyrrolidin-3-ol?
The canonical SMILES for 3-(cycloocten-1-yl)-1-cyclopropylpyrrolidin-3-ol is OC1(C2=CCCCCCC2)CCN(C2CC2)C1.
What is the InChIKey of 3-(cycloocten-1-yl)-1-cyclopropylpyrrolidin-3-ol?
The InChIKey is WNRKIRKDGZWNRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO/c17-15(10-11-16(12-15)14-8-9-14)13-6-4-2-1-3-5-7-13/h6,14,17H,1-5,7-12H2.
What are the key properties of 3-(cycloocten-1-yl)-1-cyclopropylpyrrolidin-3-ol?
3-(cycloocten-1-yl)-1-cyclopropylpyrrolidin-3-ol has a molecular weight of 235.37 g/mol, XLogP of 2.87, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cycloocten-1-yl)-1-cyclopropylpyrrolidin-3-ol is sourced from PubChem (CID 106650887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).