(1S)-1-(2,4-difluorophenyl)-N-[(2-morpholin-4-ylphenyl)methyl]ethanamine

C19H22F2N2O — CID 95177706

IUPAC(1S)-1-(2,4-difluorophenyl)-N-[(2-morpholin-4-ylphenyl)methyl]ethanamine
SMILESC[C@H](NCc1ccccc1N1CCOCC1)c1ccc(F)cc1F
InChIInChI=1S/C19H22F2N2O/c1-14(17-7-6-16(20)12-18(17)21)22-13-15-4-2-3-5-19(15)23-8-10-24-11-9-23/h2-7,12,14,22H,8-11,13H2,1H3/t14-/m0/s1
InChIKeyJBPWOXGSAJHXIG-AWEZNQCLSA-N
MW332.39 g/mol
LogP3.65
Rot. Bonds5

About (1S)-1-(2,4-difluorophenyl)-N-[(2-morpholin-4-ylphenyl)methyl]ethanamine

(1S)-1-(2,4-difluorophenyl)-N-[(2-morpholin-4-ylphenyl)methyl]ethanamine (PubChem CID 95177706) has the molecular formula C19H22F2N2O and a molecular weight of 332.39 g/mol. Its IUPAC name is (1S)-1-(2,4-difluorophenyl)-N-[(2-morpholin-4-ylphenyl)methyl]ethanamine.

Molecular Properties

Compound Name(1S)-1-(2,4-difluorophenyl)-N-[(2-morpholin-4-ylphenyl)methyl]ethanamine
PubChem CID95177706
Molecular FormulaC19H22F2N2O
Molecular Weight332.39 g/mol
Exact Mass332.17
IUPAC Name(1S)-1-(2,4-difluorophenyl)-N-[(2-morpholin-4-ylphenyl)methyl]ethanamine
SMILESC[C@H](NCc1ccccc1N1CCOCC1)c1ccc(F)cc1F
InChIInChI=1S/C19H22F2N2O/c1-14(17-7-6-16(20)12-18(17)21)22-13-15-4-2-3-5-19(15)23-8-10-24-11-9-23/h2-7,12,14,22H,8-11,13H2,1H3/t14-/m0/s1
InChIKeyJBPWOXGSAJHXIG-AWEZNQCLSA-N
XLogP3.65
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.39
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (1S)-1-(2,4-difluorophenyl)-N-[(2-morpholin-4-ylphenyl)methyl]ethanamine 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

(1S)-1-(2-methoxyphenyl)-N-[(2-morpholin-4-ylphenyl)methyl]ethanamine
CID 95177714
1-(2,4-difluorophenyl)-N-(2-morpholin-4-ylethyl)ethanamine
CID 43178928
1-(2,4-difluorophenyl)-N-[(2,4-difluorophenyl)methyl]ethanamine
CID 43221741
1-(2,4-difluorophenyl)-N-[(2,3-difluorophenyl)methyl]ethanamine
CID 60713896
2-methyl-N-[(2-morpholin-4-ylphenyl)methyl]propanamide
CID 47400471
(1R)-N-[(3-fluoro-4-morpholin-4-ylphenyl)methyl]-1-(4-fluorophenyl)ethanamine
CID 95177713
N-[1-[5-fluoro-2-(1,4-oxazepan-4-yl)phenyl]ethyl]propan-1-amine
CID 62974863
(2R)-N-[(2-morpholin-4-ylphenyl)methyl]-1-pyrazol-1-ylpropan-2-amine
CID 95275011
2-[1-(2,4-difluorophenyl)ethylamino]-1-[4-(2-morpholin-4-yl-2-oxoethyl)piperazin-1-yl]ethanone
CID 112796891
1-[(5-fluoro-2-morpholin-4-ylphenyl)methyl]-2-phenylhydrazine
CID 169386637
1-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-2-methyl-3-[(2-morpholin-4-ylphenyl)methyl]guanidine
CID 111889701
1-[(2-fluorophenyl)methyl]-2-methyl-3-[(2-morpholin-4-ylphenyl)methyl]guanidine
CID 111266589

Frequently Asked Questions

What is the IUPAC name of (1S)-1-(2,4-difluorophenyl)-N-[(2-morpholin-4-ylphenyl)methyl]ethanamine?
The IUPAC name of (1S)-1-(2,4-difluorophenyl)-N-[(2-morpholin-4-ylphenyl)methyl]ethanamine (CID 95177706) is (1S)-1-(2,4-difluorophenyl)-N-[(2-morpholin-4-ylphenyl)methyl]ethanamine.
What is the SMILES notation for (1S)-1-(2,4-difluorophenyl)-N-[(2-morpholin-4-ylphenyl)methyl]ethanamine?
The canonical SMILES for (1S)-1-(2,4-difluorophenyl)-N-[(2-morpholin-4-ylphenyl)methyl]ethanamine is C[C@H](NCc1ccccc1N1CCOCC1)c1ccc(F)cc1F.
What is the InChIKey of (1S)-1-(2,4-difluorophenyl)-N-[(2-morpholin-4-ylphenyl)methyl]ethanamine?
The InChIKey is JBPWOXGSAJHXIG-AWEZNQCLSA-N. The full InChI is InChI=1S/C19H22F2N2O/c1-14(17-7-6-16(20)12-18(17)21)22-13-15-4-2-3-5-19(15)23-8-10-24-11-9-23/h2-7,12,14,22H,8-11,13H2,1H3/t14-/m0/s1.
What are the key properties of (1S)-1-(2,4-difluorophenyl)-N-[(2-morpholin-4-ylphenyl)methyl]ethanamine?
(1S)-1-(2,4-difluorophenyl)-N-[(2-morpholin-4-ylphenyl)methyl]ethanamine has a molecular weight of 332.39 g/mol, XLogP of 3.65, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-(2,4-difluorophenyl)-N-[(2-morpholin-4-ylphenyl)methyl]ethanamine is sourced from PubChem (CID 95177706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).