(2-fluoro-3-pyrrolidin-1-ylphenyl)methanol

C11H14FNO — CID 129045919

IUPAC(2-fluoro-3-pyrrolidin-1-ylphenyl)methanol
SMILESOCc1cccc(N2CCCC2)c1F
InChIInChI=1S/C11H14FNO/c12-11-9(8-14)4-3-5-10(11)13-6-1-2-7-13/h3-5,14H,1-2,6-8H2
InChIKeyGHRHFYCMCNZOMU-UHFFFAOYSA-N
MW195.24 g/mol
LogP1.92
Rot. Bonds2

About (2-fluoro-3-pyrrolidin-1-ylphenyl)methanol

(2-fluoro-3-pyrrolidin-1-ylphenyl)methanol (PubChem CID 129045919) has the molecular formula C11H14FNO and a molecular weight of 195.24 g/mol. Its IUPAC name is (2-fluoro-3-pyrrolidin-1-ylphenyl)methanol.

Molecular Properties

Compound Name(2-fluoro-3-pyrrolidin-1-ylphenyl)methanol
PubChem CID129045919
Molecular FormulaC11H14FNO
Molecular Weight195.24 g/mol
Exact Mass195.11
IUPAC Name(2-fluoro-3-pyrrolidin-1-ylphenyl)methanol
SMILESOCc1cccc(N2CCCC2)c1F
InChIInChI=1S/C11H14FNO/c12-11-9(8-14)4-3-5-10(11)13-6-1-2-7-13/h3-5,14H,1-2,6-8H2
InChIKeyGHRHFYCMCNZOMU-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 (2-fluoro-3-pyrrolidin-1-ylphenyl)methanol?
The IUPAC name of (2-fluoro-3-pyrrolidin-1-ylphenyl)methanol (CID 129045919) is (2-fluoro-3-pyrrolidin-1-ylphenyl)methanol.
What is the SMILES notation for (2-fluoro-3-pyrrolidin-1-ylphenyl)methanol?
The canonical SMILES for (2-fluoro-3-pyrrolidin-1-ylphenyl)methanol is OCc1cccc(N2CCCC2)c1F.
What is the InChIKey of (2-fluoro-3-pyrrolidin-1-ylphenyl)methanol?
The InChIKey is GHRHFYCMCNZOMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FNO/c12-11-9(8-14)4-3-5-10(11)13-6-1-2-7-13/h3-5,14H,1-2,6-8H2.
What are the key properties of (2-fluoro-3-pyrrolidin-1-ylphenyl)methanol?
(2-fluoro-3-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 (2-fluoro-3-pyrrolidin-1-ylphenyl)methanol is sourced from PubChem (CID 129045919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).