[1-(2-fluoroethyl)pyrrolidin-3-yl]methanol

C7H14FNO — CID 80695796

IUPAC[1-(2-fluoroethyl)pyrrolidin-3-yl]methanol
SMILESOCC1CCN(CCF)C1
InChIInChI=1S/C7H14FNO/c8-2-4-9-3-1-7(5-9)6-10/h7,10H,1-6H2
InChIKeyZRGJUWIOCWWMPZ-UHFFFAOYSA-N
MW147.19 g/mol
LogP0.27
Rot. Bonds3

About [1-(2-fluoroethyl)pyrrolidin-3-yl]methanol

[1-(2-fluoroethyl)pyrrolidin-3-yl]methanol (PubChem CID 80695796) has the molecular formula C7H14FNO and a molecular weight of 147.19 g/mol. Its IUPAC name is [1-(2-fluoroethyl)pyrrolidin-3-yl]methanol.

Molecular Properties

Compound Name[1-(2-fluoroethyl)pyrrolidin-3-yl]methanol
PubChem CID80695796
Molecular FormulaC7H14FNO
Molecular Weight147.19 g/mol
Exact Mass147.11
IUPAC Name[1-(2-fluoroethyl)pyrrolidin-3-yl]methanol
SMILESOCC1CCN(CCF)C1
InChIInChI=1S/C7H14FNO/c8-2-4-9-3-1-7(5-9)6-10/h7,10H,1-6H2
InChIKeyZRGJUWIOCWWMPZ-UHFFFAOYSA-N
XLogP0.27
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.19
LogP ≤ 50.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [1-(2-fluoroethyl)pyrrolidin-3-yl]methanol?
The IUPAC name of [1-(2-fluoroethyl)pyrrolidin-3-yl]methanol (CID 80695796) is [1-(2-fluoroethyl)pyrrolidin-3-yl]methanol.
What is the SMILES notation for [1-(2-fluoroethyl)pyrrolidin-3-yl]methanol?
The canonical SMILES for [1-(2-fluoroethyl)pyrrolidin-3-yl]methanol is OCC1CCN(CCF)C1.
What is the InChIKey of [1-(2-fluoroethyl)pyrrolidin-3-yl]methanol?
The InChIKey is ZRGJUWIOCWWMPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14FNO/c8-2-4-9-3-1-7(5-9)6-10/h7,10H,1-6H2.
What are the key properties of [1-(2-fluoroethyl)pyrrolidin-3-yl]methanol?
[1-(2-fluoroethyl)pyrrolidin-3-yl]methanol has a molecular weight of 147.19 g/mol, XLogP of 0.27, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-fluoroethyl)pyrrolidin-3-yl]methanol is sourced from PubChem (CID 80695796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).