(4-fluoro-2-pyrrolidin-1-ylphenyl)methanol

C11H14FNO — CID 117115788

IUPAC(4-fluoro-2-pyrrolidin-1-ylphenyl)methanol
SMILESOCc1ccc(F)cc1N1CCCC1
InChIInChI=1S/C11H14FNO/c12-10-4-3-9(8-14)11(7-10)13-5-1-2-6-13/h3-4,7,14H,1-2,5-6,8H2
InChIKeyHMRWICIZCNEPFE-UHFFFAOYSA-N
MW195.24 g/mol
LogP1.92
Rot. Bonds2

About (4-fluoro-2-pyrrolidin-1-ylphenyl)methanol

(4-fluoro-2-pyrrolidin-1-ylphenyl)methanol (PubChem CID 117115788) has the molecular formula C11H14FNO and a molecular weight of 195.24 g/mol. Its IUPAC name is (4-fluoro-2-pyrrolidin-1-ylphenyl)methanol.

Molecular Properties

Compound Name(4-fluoro-2-pyrrolidin-1-ylphenyl)methanol
PubChem CID117115788
Molecular FormulaC11H14FNO
Molecular Weight195.24 g/mol
Exact Mass195.11
IUPAC Name(4-fluoro-2-pyrrolidin-1-ylphenyl)methanol
SMILESOCc1ccc(F)cc1N1CCCC1
InChIInChI=1S/C11H14FNO/c12-10-4-3-9(8-14)11(7-10)13-5-1-2-6-13/h3-4,7,14H,1-2,5-6,8H2
InChIKeyHMRWICIZCNEPFE-UHFFFAOYSA-N
XLogP1.92
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.24
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4-fluoro-2-pyrrolidin-1-ylphenyl)methanol?
The IUPAC name of (4-fluoro-2-pyrrolidin-1-ylphenyl)methanol (CID 117115788) is (4-fluoro-2-pyrrolidin-1-ylphenyl)methanol.
What is the SMILES notation for (4-fluoro-2-pyrrolidin-1-ylphenyl)methanol?
The canonical SMILES for (4-fluoro-2-pyrrolidin-1-ylphenyl)methanol is OCc1ccc(F)cc1N1CCCC1.
What is the InChIKey of (4-fluoro-2-pyrrolidin-1-ylphenyl)methanol?
The InChIKey is HMRWICIZCNEPFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FNO/c12-10-4-3-9(8-14)11(7-10)13-5-1-2-6-13/h3-4,7,14H,1-2,5-6,8H2.
What are the key properties of (4-fluoro-2-pyrrolidin-1-ylphenyl)methanol?
(4-fluoro-2-pyrrolidin-1-ylphenyl)methanol has a molecular weight of 195.24 g/mol, XLogP of 1.92, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluoro-2-pyrrolidin-1-ylphenyl)methanol is sourced from PubChem (CID 117115788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).