2-fluoromorpholin-4-amine

C4H9FN2O — CID 151563338

IUPAC2-fluoromorpholin-4-amine
SMILESNN1CCOC(F)C1
InChIInChI=1S/C4H9FN2O/c5-4-3-7(6)1-2-8-4/h4H,1-3,6H2
InChIKeyQCXVLSZYOGHGBM-UHFFFAOYSA-N
MW120.13 g/mol
LogP-0.51
Rot. Bonds

About 2-fluoromorpholin-4-amine

2-fluoromorpholin-4-amine (PubChem CID 151563338) has the molecular formula C4H9FN2O and a molecular weight of 120.13 g/mol. Its IUPAC name is 2-fluoromorpholin-4-amine.

Molecular Properties

Compound Name2-fluoromorpholin-4-amine
PubChem CID151563338
Molecular FormulaC4H9FN2O
Molecular Weight120.13 g/mol
Exact Mass120.07
IUPAC Name2-fluoromorpholin-4-amine
SMILESNN1CCOC(F)C1
InChIInChI=1S/C4H9FN2O/c5-4-3-7(6)1-2-8-4/h4H,1-3,6H2
InChIKeyQCXVLSZYOGHGBM-UHFFFAOYSA-N
XLogP-0.51
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.13
LogP ≤ 5-0.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-fluoromorpholin-4-amine?
The IUPAC name of 2-fluoromorpholin-4-amine (CID 151563338) is 2-fluoromorpholin-4-amine.
What is the SMILES notation for 2-fluoromorpholin-4-amine?
The canonical SMILES for 2-fluoromorpholin-4-amine is NN1CCOC(F)C1.
What is the InChIKey of 2-fluoromorpholin-4-amine?
The InChIKey is QCXVLSZYOGHGBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9FN2O/c5-4-3-7(6)1-2-8-4/h4H,1-3,6H2.
What are the key properties of 2-fluoromorpholin-4-amine?
2-fluoromorpholin-4-amine has a molecular weight of 120.13 g/mol, XLogP of -0.51, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoromorpholin-4-amine is sourced from PubChem (CID 151563338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).