2-[4-(2-fluoroethyl)morpholin-2-yl]acetic acid

C8H14FNO3 — CID 80694629

IUPAC2-[4-(2-fluoroethyl)morpholin-2-yl]acetic acid
SMILESO=C(O)CC1CN(CCF)CCO1
InChIInChI=1S/C8H14FNO3/c9-1-2-10-3-4-13-7(6-10)5-8(11)12/h7H,1-6H2,(H,11,12)
InChIKeyNUYLYJOSYOMSIG-UHFFFAOYSA-N
MW191.20 g/mol
LogP0.13
Rot. Bonds4

About 2-[4-(2-fluoroethyl)morpholin-2-yl]acetic acid

2-[4-(2-fluoroethyl)morpholin-2-yl]acetic acid (PubChem CID 80694629) has the molecular formula C8H14FNO3 and a molecular weight of 191.20 g/mol. Its IUPAC name is 2-[4-(2-fluoroethyl)morpholin-2-yl]acetic acid.

Molecular Properties

Compound Name2-[4-(2-fluoroethyl)morpholin-2-yl]acetic acid
PubChem CID80694629
Molecular FormulaC8H14FNO3
Molecular Weight191.20 g/mol
Exact Mass191.10
IUPAC Name2-[4-(2-fluoroethyl)morpholin-2-yl]acetic acid
SMILESO=C(O)CC1CN(CCF)CCO1
InChIInChI=1S/C8H14FNO3/c9-1-2-10-3-4-13-7(6-10)5-8(11)12/h7H,1-6H2,(H,11,12)
InChIKeyNUYLYJOSYOMSIG-UHFFFAOYSA-N
XLogP0.13
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.20
LogP ≤ 50.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-fluoroethyl)morpholin-2-yl]acetic acid?
The IUPAC name of 2-[4-(2-fluoroethyl)morpholin-2-yl]acetic acid (CID 80694629) is 2-[4-(2-fluoroethyl)morpholin-2-yl]acetic acid.
What is the SMILES notation for 2-[4-(2-fluoroethyl)morpholin-2-yl]acetic acid?
The canonical SMILES for 2-[4-(2-fluoroethyl)morpholin-2-yl]acetic acid is O=C(O)CC1CN(CCF)CCO1.
What is the InChIKey of 2-[4-(2-fluoroethyl)morpholin-2-yl]acetic acid?
The InChIKey is NUYLYJOSYOMSIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14FNO3/c9-1-2-10-3-4-13-7(6-10)5-8(11)12/h7H,1-6H2,(H,11,12).
What are the key properties of 2-[4-(2-fluoroethyl)morpholin-2-yl]acetic acid?
2-[4-(2-fluoroethyl)morpholin-2-yl]acetic acid has a molecular weight of 191.20 g/mol, XLogP of 0.13, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-fluoroethyl)morpholin-2-yl]acetic acid is sourced from PubChem (CID 80694629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).