(3,5-difluoro-4-morpholin-4-ylphenyl)methanamine

C11H14F2N2O — CID 22337573

IUPAC(3,5-difluoro-4-morpholin-4-ylphenyl)methanamine
SMILESNCc1cc(F)c(N2CCOCC2)c(F)c1
InChIInChI=1S/C11H14F2N2O/c12-9-5-8(7-14)6-10(13)11(9)15-1-3-16-4-2-15/h5-6H,1-4,7,14H2
InChIKeyXZVHIFLULLZICN-UHFFFAOYSA-N
MW228.24 g/mol
LogP1.26
Rot. Bonds2

About (3,5-difluoro-4-morpholin-4-ylphenyl)methanamine

(3,5-difluoro-4-morpholin-4-ylphenyl)methanamine (PubChem CID 22337573) has the molecular formula C11H14F2N2O and a molecular weight of 228.24 g/mol. Its IUPAC name is (3,5-difluoro-4-morpholin-4-ylphenyl)methanamine.

Molecular Properties

Compound Name(3,5-difluoro-4-morpholin-4-ylphenyl)methanamine
PubChem CID22337573
Molecular FormulaC11H14F2N2O
Molecular Weight228.24 g/mol
Exact Mass228.11
IUPAC Name(3,5-difluoro-4-morpholin-4-ylphenyl)methanamine
SMILESNCc1cc(F)c(N2CCOCC2)c(F)c1
InChIInChI=1S/C11H14F2N2O/c12-9-5-8(7-14)6-10(13)11(9)15-1-3-16-4-2-15/h5-6H,1-4,7,14H2
InChIKeyXZVHIFLULLZICN-UHFFFAOYSA-N
XLogP1.26
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.24
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (3,5-difluoro-4-morpholin-4-ylphenyl)methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-Amino-4-(trifluoromethyl)phenyl)morpholine
CID 136624
4-(Morpholinomethyl)aniline
CID 776851
4-Morpholinobenzonitrile
CID 394808
4-(Morpholin-4-yl)-2-(trifluoromethyl)aniline
CID 822225
(4-Morpholin-4-ylbenzylidene)malononitrile
CID 321779
(2-(Morpholin-4-yl)phenyl)methanamine
CID 2776563
4-(p-Tolyl)morpholine
CID 766255
4-Morpholinobenzylamine
CID 2776458
2-Fluoro-6-morpholinobenzonitrile
CID 654627
Morpholine, 4-(p-anilinobenzyl)-
CID 100777
[3-Fluoro-4-(morpholin-4-yl)phenyl]methanamine
CID 11572017
N,N-dimethyl-4-(2-morpholin-4-ylethyl)aniline
CID 3830898

Frequently Asked Questions

What is the IUPAC name of (3,5-difluoro-4-morpholin-4-ylphenyl)methanamine?
The IUPAC name of (3,5-difluoro-4-morpholin-4-ylphenyl)methanamine (CID 22337573) is (3,5-difluoro-4-morpholin-4-ylphenyl)methanamine.
What is the SMILES notation for (3,5-difluoro-4-morpholin-4-ylphenyl)methanamine?
The canonical SMILES for (3,5-difluoro-4-morpholin-4-ylphenyl)methanamine is NCc1cc(F)c(N2CCOCC2)c(F)c1.
What is the InChIKey of (3,5-difluoro-4-morpholin-4-ylphenyl)methanamine?
The InChIKey is XZVHIFLULLZICN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F2N2O/c12-9-5-8(7-14)6-10(13)11(9)15-1-3-16-4-2-15/h5-6H,1-4,7,14H2.
What are the key properties of (3,5-difluoro-4-morpholin-4-ylphenyl)methanamine?
(3,5-difluoro-4-morpholin-4-ylphenyl)methanamine has a molecular weight of 228.24 g/mol, XLogP of 1.26, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-difluoro-4-morpholin-4-ylphenyl)methanamine is sourced from PubChem (CID 22337573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).