1-(1,2-diethyl-4-fluoropyrrolidin-2-yl)cyclopropan-1-ol

C11H20FNO — CID 166533988

IUPAC1-(1,2-diethyl-4-fluoropyrrolidin-2-yl)cyclopropan-1-ol
SMILESCCN1CC(F)CC1(CC)C1(O)CC1
InChIInChI=1S/C11H20FNO/c1-3-10(11(14)5-6-11)7-9(12)8-13(10)4-2/h9,14H,3-8H2,1-2H3
InChIKeyUHQZMHSWOOYYHF-UHFFFAOYSA-N
MW201.28 g/mol
LogP1.72
Rot. Bonds3

About 1-(1,2-diethyl-4-fluoropyrrolidin-2-yl)cyclopropan-1-ol

1-(1,2-diethyl-4-fluoropyrrolidin-2-yl)cyclopropan-1-ol (PubChem CID 166533988) has the molecular formula C11H20FNO and a molecular weight of 201.28 g/mol. Its IUPAC name is 1-(1,2-diethyl-4-fluoropyrrolidin-2-yl)cyclopropan-1-ol.

Molecular Properties

Compound Name1-(1,2-diethyl-4-fluoropyrrolidin-2-yl)cyclopropan-1-ol
PubChem CID166533988
Molecular FormulaC11H20FNO
Molecular Weight201.28 g/mol
Exact Mass201.15
IUPAC Name1-(1,2-diethyl-4-fluoropyrrolidin-2-yl)cyclopropan-1-ol
SMILESCCN1CC(F)CC1(CC)C1(O)CC1
InChIInChI=1S/C11H20FNO/c1-3-10(11(14)5-6-11)7-9(12)8-13(10)4-2/h9,14H,3-8H2,1-2H3
InChIKeyUHQZMHSWOOYYHF-UHFFFAOYSA-N
XLogP1.72
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.28
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(2R)-1-tert-butyl-4,4-difluoropyrrolidin-2-yl]propan-2-ol
CID 155201050
1-(2-Fluoro-1,2,3,5,6,7-hexahydropyrrolizin-8-yl)cyclopropan-1-ol
CID 164878377
[(2S,4R)-4-fluoro-1-methyl-2-propylpyrrolidin-2-yl]methanol
CID 164878972
1-(2-Ethyl-4-fluoropyrrolidin-2-yl)cyclopropan-1-ol
CID 171827118
1-[1-[(2,2-Difluorocyclopropyl)methyl]-2,3,3-trimethylpyrrolidin-2-yl]-2-methylpropane-1,1-diol
CID 172287881
1-[5-[(2-Fluorocyclopropyl)methyl]-4-methyl-5-azaspiro[2.4]heptan-4-yl]-2-methylpropane-1,1-diol
CID 172288483
1-[(4R)-5-[(2-fluorocyclopropyl)-dihydroxymethyl]-4-methyl-5-azaspiro[2.4]heptan-4-yl]propane-1,1-diol
CID 172288614
1-[(2R)-1-[(2,2-difluorocyclopropyl)methyl]-2,3,3-trimethylpyrrolidin-2-yl]ethane-1,1-diol;ethane
CID 172289088
1-[1-[(2,2-Difluorocyclopropyl)methyl]-2,3,3-trimethylpyrrolidin-2-yl]ethane-1,1-diol;ethane
CID 176951133
1-[(2R)-1-[(2-fluorocyclopropyl)methyl]-2,3,3-trimethylpyrrolidin-2-yl]-2-methylpropane-1,1-diol
CID 176951333
1-[(2R)-1-[(2,2-difluorocyclopropyl)methyl]-2,3,3-trimethylpyrrolidin-2-yl]ethane-1,1-diol
CID 172288342
1-[1-[(2,2-Difluorocyclopropyl)methyl]-2,3,3-trimethylpyrrolidin-2-yl]ethane-1,1-diol
CID 176951134

Frequently Asked Questions

What is the IUPAC name of 1-(1,2-diethyl-4-fluoropyrrolidin-2-yl)cyclopropan-1-ol?
The IUPAC name of 1-(1,2-diethyl-4-fluoropyrrolidin-2-yl)cyclopropan-1-ol (CID 166533988) is 1-(1,2-diethyl-4-fluoropyrrolidin-2-yl)cyclopropan-1-ol.
What is the SMILES notation for 1-(1,2-diethyl-4-fluoropyrrolidin-2-yl)cyclopropan-1-ol?
The canonical SMILES for 1-(1,2-diethyl-4-fluoropyrrolidin-2-yl)cyclopropan-1-ol is CCN1CC(F)CC1(CC)C1(O)CC1.
What is the InChIKey of 1-(1,2-diethyl-4-fluoropyrrolidin-2-yl)cyclopropan-1-ol?
The InChIKey is UHQZMHSWOOYYHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20FNO/c1-3-10(11(14)5-6-11)7-9(12)8-13(10)4-2/h9,14H,3-8H2,1-2H3.
What are the key properties of 1-(1,2-diethyl-4-fluoropyrrolidin-2-yl)cyclopropan-1-ol?
1-(1,2-diethyl-4-fluoropyrrolidin-2-yl)cyclopropan-1-ol has a molecular weight of 201.28 g/mol, XLogP of 1.72, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,2-diethyl-4-fluoropyrrolidin-2-yl)cyclopropan-1-ol is sourced from PubChem (CID 166533988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).