(3-fluoro-4-morpholin-4-ylphenyl)methanamine

C11H15FN2O — CID 11572017

IUPAC(3-fluoro-4-morpholin-4-ylphenyl)methanamine
SMILESNCc1ccc(N2CCOCC2)c(F)c1
InChIInChI=1S/C11H15FN2O/c12-10-7-9(8-13)1-2-11(10)14-3-5-15-6-4-14/h1-2,7H,3-6,8,13H2
InChIKeyGULVUKFJQUDLSH-UHFFFAOYSA-N
MW210.25 g/mol
LogP1.12
Rot. Bonds2

About (3-fluoro-4-morpholin-4-ylphenyl)methanamine

(3-fluoro-4-morpholin-4-ylphenyl)methanamine (PubChem CID 11572017) has the molecular formula C11H15FN2O and a molecular weight of 210.25 g/mol. Its IUPAC name is (3-fluoro-4-morpholin-4-ylphenyl)methanamine.

Molecular Properties

Compound Name(3-fluoro-4-morpholin-4-ylphenyl)methanamine
PubChem CID11572017
Molecular FormulaC11H15FN2O
Molecular Weight210.25 g/mol
Exact Mass210.12
IUPAC Name(3-fluoro-4-morpholin-4-ylphenyl)methanamine
SMILESNCc1ccc(N2CCOCC2)c(F)c1
InChIInChI=1S/C11H15FN2O/c12-10-7-9(8-13)1-2-11(10)14-3-5-15-6-4-14/h1-2,7H,3-6,8,13H2
InChIKeyGULVUKFJQUDLSH-UHFFFAOYSA-N
XLogP1.12
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.25
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3-fluoro-4-morpholin-4-ylphenyl)methanamine?
The IUPAC name of (3-fluoro-4-morpholin-4-ylphenyl)methanamine (CID 11572017) is (3-fluoro-4-morpholin-4-ylphenyl)methanamine.
What is the SMILES notation for (3-fluoro-4-morpholin-4-ylphenyl)methanamine?
The canonical SMILES for (3-fluoro-4-morpholin-4-ylphenyl)methanamine is NCc1ccc(N2CCOCC2)c(F)c1.
What is the InChIKey of (3-fluoro-4-morpholin-4-ylphenyl)methanamine?
The InChIKey is GULVUKFJQUDLSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15FN2O/c12-10-7-9(8-13)1-2-11(10)14-3-5-15-6-4-14/h1-2,7H,3-6,8,13H2.
What are the key properties of (3-fluoro-4-morpholin-4-ylphenyl)methanamine?
(3-fluoro-4-morpholin-4-ylphenyl)methanamine has a molecular weight of 210.25 g/mol, XLogP of 1.12, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluoro-4-morpholin-4-ylphenyl)methanamine is sourced from PubChem (CID 11572017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).