(4-fluorophenyl)-(4-methylmorpholin-2-yl)methanamine

C12H17FN2O — CID 79093624

IUPAC(4-fluorophenyl)-(4-methylmorpholin-2-yl)methanamine
SMILESCN1CCOC(C(N)c2ccc(F)cc2)C1
InChIInChI=1S/C12H17FN2O/c1-15-6-7-16-11(8-15)12(14)9-2-4-10(13)5-3-9/h2-5,11-12H,6-8,14H2,1H3
InChIKeyDGAYWNDTOKMNIF-UHFFFAOYSA-N
MW224.28 g/mol
LogP1.16
Rot. Bonds2

About (4-fluorophenyl)-(4-methylmorpholin-2-yl)methanamine

(4-fluorophenyl)-(4-methylmorpholin-2-yl)methanamine (PubChem CID 79093624) has the molecular formula C12H17FN2O and a molecular weight of 224.28 g/mol. Its IUPAC name is (4-fluorophenyl)-(4-methylmorpholin-2-yl)methanamine.

Molecular Properties

Compound Name(4-fluorophenyl)-(4-methylmorpholin-2-yl)methanamine
PubChem CID79093624
Molecular FormulaC12H17FN2O
Molecular Weight224.28 g/mol
Exact Mass224.13
IUPAC Name(4-fluorophenyl)-(4-methylmorpholin-2-yl)methanamine
SMILESCN1CCOC(C(N)c2ccc(F)cc2)C1
InChIInChI=1S/C12H17FN2O/c1-15-6-7-16-11(8-15)12(14)9-2-4-10(13)5-3-9/h2-5,11-12H,6-8,14H2,1H3
InChIKeyDGAYWNDTOKMNIF-UHFFFAOYSA-N
XLogP1.16
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.28
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-methoxyphenyl)-(4-methylmorpholin-2-yl)methanamine
CID 79093138
(4-chloro-3-methoxyphenyl)-(4-methylmorpholin-2-yl)methanamine
CID 79699140
(4-methylmorpholin-2-yl)-[3-(2-methylpropyl)phenyl]methanamine
CID 116544706
(2R)-2-(4-fluorophenyl)-4-methylmorpholine
CID 67355003
(4-methylmorpholin-2-yl)-[4-(trifluoromethyl)-3-pyridinyl]methanamine
CID 102708320
2-(3,4-difluorophenyl)-1-(4-methylmorpholin-2-yl)ethanamine
CID 82922361
(2-cyclobutylphenyl)-(4-methylmorpholin-2-yl)methanamine
CID 114603817
1-(3-fluorophenyl)-N-methyl-1-(4-methylmorpholin-2-yl)methanamine
CID 79093150
1-[4-[(4-fluorophenyl)methyl]morpholin-2-yl]ethanamine
CID 81491103
phenyl-(4-propylmorpholin-2-yl)methanamine
CID 79657763
(4-methylmorpholin-2-yl)-(1,3-thiazol-5-yl)methanamine
CID 164659077
phenyl-(4-propan-2-ylmorpholin-2-yl)methanamine
CID 79665183

Frequently Asked Questions

What is the IUPAC name of (4-fluorophenyl)-(4-methylmorpholin-2-yl)methanamine?
The IUPAC name of (4-fluorophenyl)-(4-methylmorpholin-2-yl)methanamine (CID 79093624) is (4-fluorophenyl)-(4-methylmorpholin-2-yl)methanamine.
What is the SMILES notation for (4-fluorophenyl)-(4-methylmorpholin-2-yl)methanamine?
The canonical SMILES for (4-fluorophenyl)-(4-methylmorpholin-2-yl)methanamine is CN1CCOC(C(N)c2ccc(F)cc2)C1.
What is the InChIKey of (4-fluorophenyl)-(4-methylmorpholin-2-yl)methanamine?
The InChIKey is DGAYWNDTOKMNIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17FN2O/c1-15-6-7-16-11(8-15)12(14)9-2-4-10(13)5-3-9/h2-5,11-12H,6-8,14H2,1H3.
What are the key properties of (4-fluorophenyl)-(4-methylmorpholin-2-yl)methanamine?
(4-fluorophenyl)-(4-methylmorpholin-2-yl)methanamine has a molecular weight of 224.28 g/mol, XLogP of 1.16, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluorophenyl)-(4-methylmorpholin-2-yl)methanamine is sourced from PubChem (CID 79093624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).