N-(2-fluoroethyl)-1-morpholin-4-ylpropan-2-amine

C9H19FN2O — CID 80694695

IUPACN-(2-fluoroethyl)-1-morpholin-4-ylpropan-2-amine
SMILESCC(CN1CCOCC1)NCCF
InChIInChI=1S/C9H19FN2O/c1-9(11-3-2-10)8-12-4-6-13-7-5-12/h9,11H,2-8H2,1H3
InChIKeyFUGUYMPEMCOLSM-UHFFFAOYSA-N
MW190.26 g/mol
LogP0.27
Rot. Bonds5

About N-(2-fluoroethyl)-1-morpholin-4-ylpropan-2-amine

N-(2-fluoroethyl)-1-morpholin-4-ylpropan-2-amine (PubChem CID 80694695) has the molecular formula C9H19FN2O and a molecular weight of 190.26 g/mol. Its IUPAC name is N-(2-fluoroethyl)-1-morpholin-4-ylpropan-2-amine.

Molecular Properties

Compound NameN-(2-fluoroethyl)-1-morpholin-4-ylpropan-2-amine
PubChem CID80694695
Molecular FormulaC9H19FN2O
Molecular Weight190.26 g/mol
Exact Mass190.15
IUPAC NameN-(2-fluoroethyl)-1-morpholin-4-ylpropan-2-amine
SMILESCC(CN1CCOCC1)NCCF
InChIInChI=1S/C9H19FN2O/c1-9(11-3-2-10)8-12-4-6-13-7-5-12/h9,11H,2-8H2,1H3
InChIKeyFUGUYMPEMCOLSM-UHFFFAOYSA-N
XLogP0.27
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.26
LogP ≤ 50.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-fluoroethyl)-1-morpholin-4-ylpropan-2-amine?
The IUPAC name of N-(2-fluoroethyl)-1-morpholin-4-ylpropan-2-amine (CID 80694695) is N-(2-fluoroethyl)-1-morpholin-4-ylpropan-2-amine.
What is the SMILES notation for N-(2-fluoroethyl)-1-morpholin-4-ylpropan-2-amine?
The canonical SMILES for N-(2-fluoroethyl)-1-morpholin-4-ylpropan-2-amine is CC(CN1CCOCC1)NCCF.
What is the InChIKey of N-(2-fluoroethyl)-1-morpholin-4-ylpropan-2-amine?
The InChIKey is FUGUYMPEMCOLSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19FN2O/c1-9(11-3-2-10)8-12-4-6-13-7-5-12/h9,11H,2-8H2,1H3.
What are the key properties of N-(2-fluoroethyl)-1-morpholin-4-ylpropan-2-amine?
N-(2-fluoroethyl)-1-morpholin-4-ylpropan-2-amine has a molecular weight of 190.26 g/mol, XLogP of 0.27, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoroethyl)-1-morpholin-4-ylpropan-2-amine is sourced from PubChem (CID 80694695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).