[1-[(2-fluorophenyl)methyl]pyrrolidin-2-yl]methanol

C12H16FNO — CID 5100175

IUPAC[1-[(2-fluorophenyl)methyl]pyrrolidin-2-yl]methanol
SMILESOCC1CCCN1Cc1ccccc1F
InChIInChI=1S/C12H16FNO/c13-12-6-2-1-4-10(12)8-14-7-3-5-11(14)9-15/h1-2,4,6,11,15H,3,5,7-9H2
InChIKeyUHAQAHSKJYEAMW-UHFFFAOYSA-N
MW209.26 g/mol
LogP1.78
Rot. Bonds3

About [1-[(2-fluorophenyl)methyl]pyrrolidin-2-yl]methanol

[1-[(2-fluorophenyl)methyl]pyrrolidin-2-yl]methanol (PubChem CID 5100175) has the molecular formula C12H16FNO and a molecular weight of 209.26 g/mol. Its IUPAC name is [1-[(2-fluorophenyl)methyl]pyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name[1-[(2-fluorophenyl)methyl]pyrrolidin-2-yl]methanol
PubChem CID5100175
Molecular FormulaC12H16FNO
Molecular Weight209.26 g/mol
Exact Mass209.12
IUPAC Name[1-[(2-fluorophenyl)methyl]pyrrolidin-2-yl]methanol
SMILESOCC1CCCN1Cc1ccccc1F
InChIInChI=1S/C12H16FNO/c13-12-6-2-1-4-10(12)8-14-7-3-5-11(14)9-15/h1-2,4,6,11,15H,3,5,7-9H2
InChIKeyUHAQAHSKJYEAMW-UHFFFAOYSA-N
XLogP1.78
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.26
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,2'-((Phenylmethyl)imino)bisethanol
CID 7553
(R)-(+)-1-Benzyl-3-pyrrolidinol
CID 643472
RB-042 HCl
CID 72735621
2-[(2-Fluorophenyl)methyl-(2-hydroxyethyl)amino]ethanol
CID 783973
N-benzyl-3-pyrrolidinol
CID 69889
[(2S)-1-benzylpyrrolidin-2-yl]methanol
CID 719760
(S)-(-)-1-Benzyl-3-pyrrolidinol
CID 2733875
(3R,4R)-1-Benzyl-4-hydroxy-3-pyrrolidinemethanol
CID 11579361
(1-Benzylpyrrolidin-3-yl)methanol
CID 5176654
2-[Benzyl(2-fluorobenzyl)amino]ethanol
CID 783283
2-[(3-Fluorophenyl)methyl-(phenylmethyl)amino]ethanol
CID 783344
[(2R)-1-[(4-undecylphenyl)methyl]pyrrolidin-2-yl]methanol;hydrochloride
CID 162654890

Frequently Asked Questions

What is the IUPAC name of [1-[(2-fluorophenyl)methyl]pyrrolidin-2-yl]methanol?
The IUPAC name of [1-[(2-fluorophenyl)methyl]pyrrolidin-2-yl]methanol (CID 5100175) is [1-[(2-fluorophenyl)methyl]pyrrolidin-2-yl]methanol.
What is the SMILES notation for [1-[(2-fluorophenyl)methyl]pyrrolidin-2-yl]methanol?
The canonical SMILES for [1-[(2-fluorophenyl)methyl]pyrrolidin-2-yl]methanol is OCC1CCCN1Cc1ccccc1F.
What is the InChIKey of [1-[(2-fluorophenyl)methyl]pyrrolidin-2-yl]methanol?
The InChIKey is UHAQAHSKJYEAMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FNO/c13-12-6-2-1-4-10(12)8-14-7-3-5-11(14)9-15/h1-2,4,6,11,15H,3,5,7-9H2.
What are the key properties of [1-[(2-fluorophenyl)methyl]pyrrolidin-2-yl]methanol?
[1-[(2-fluorophenyl)methyl]pyrrolidin-2-yl]methanol has a molecular weight of 209.26 g/mol, XLogP of 1.78, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(2-fluorophenyl)methyl]pyrrolidin-2-yl]methanol is sourced from PubChem (CID 5100175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).