N-[[4-(4-fluorophenyl)morpholin-3-yl]methyl]-1-(3-methoxyphenyl)ethanamine

C20H25FN2O2 — CID 72679887

IUPACN-[[4-(4-fluorophenyl)morpholin-3-yl]methyl]-1-(3-methoxyphenyl)ethanamine
SMILESCOc1cccc(C(C)NCC2COCCN2c2ccc(F)cc2)c1
InChIInChI=1S/C20H25FN2O2/c1-15(16-4-3-5-20(12-16)24-2)22-13-19-14-25-11-10-23(19)18-8-6-17(21)7-9-18/h3-9,12,15,19,22H,10-11,13-14H2,1-2H3
InChIKeyHFGLAZYOORRQAL-UHFFFAOYSA-N
MW344.43 g/mol
LogP3.39
Rot. Bonds6

About N-[[4-(4-fluorophenyl)morpholin-3-yl]methyl]-1-(3-methoxyphenyl)ethanamine

N-[[4-(4-fluorophenyl)morpholin-3-yl]methyl]-1-(3-methoxyphenyl)ethanamine (PubChem CID 72679887) has the molecular formula C20H25FN2O2 and a molecular weight of 344.43 g/mol. Its IUPAC name is N-[[4-(4-fluorophenyl)morpholin-3-yl]methyl]-1-(3-methoxyphenyl)ethanamine.

Molecular Properties

Compound NameN-[[4-(4-fluorophenyl)morpholin-3-yl]methyl]-1-(3-methoxyphenyl)ethanamine
PubChem CID72679887
Molecular FormulaC20H25FN2O2
Molecular Weight344.43 g/mol
Exact Mass344.19
IUPAC NameN-[[4-(4-fluorophenyl)morpholin-3-yl]methyl]-1-(3-methoxyphenyl)ethanamine
SMILESCOc1cccc(C(C)NCC2COCCN2c2ccc(F)cc2)c1
InChIInChI=1S/C20H25FN2O2/c1-15(16-4-3-5-20(12-16)24-2)22-13-19-14-25-11-10-23(19)18-8-6-17(21)7-9-18/h3-9,12,15,19,22H,10-11,13-14H2,1-2H3
InChIKeyHFGLAZYOORRQAL-UHFFFAOYSA-N
XLogP3.39
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.43
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[4-(4-fluorophenyl)morpholin-3-yl]methyl]-1-naphthalen-1-ylethanamine;hydrochloride
CID 72679892
N-[[4-(3-methoxyphenyl)morpholin-3-yl]methyl]-1-naphthalen-1-ylethanamine;hydrochloride
CID 72679840
[3-[[1-(3-methoxyphenyl)ethylamino]methyl]morpholin-4-yl]-phenylmethanone
CID 72680064
(1R)-1-(3-methoxyphenyl)-N-(oxolan-3-ylmethyl)ethanamine
CID 81376792
4-(3-methoxyphenyl)-3-[(3S)-3-(3-methoxyphenyl)butyl]morpholine
CID 158220581
(1S)-1-(3-methoxyphenyl)-N-(oxan-4-ylmethyl)ethanamine
CID 81376149
N-(1,4-dioxan-2-ylmethyl)-1-(3-methoxyphenyl)ethanamine
CID 54907826
1-(3-methoxyphenyl)-N-[(1-methylpyrrolidin-2-yl)methyl]ethanamine
CID 103729491
4-[[1-(3-methoxyphenyl)ethylamino]methyl]cyclohexan-1-ol
CID 106126753
(1R)-N-(cycloheptylmethyl)-1-(3-methoxyphenyl)ethanamine
CID 81375787
N-[2-(4-fluorophenyl)ethyl]-1-(3-methoxyphenyl)ethanamine
CID 43191768
(1R)-1-(3-methoxyphenyl)-N-[(4-phenylmorpholin-2-yl)methyl]ethanamine;hydrochloride
CID 159891151

Frequently Asked Questions

What is the IUPAC name of N-[[4-(4-fluorophenyl)morpholin-3-yl]methyl]-1-(3-methoxyphenyl)ethanamine?
The IUPAC name of N-[[4-(4-fluorophenyl)morpholin-3-yl]methyl]-1-(3-methoxyphenyl)ethanamine (CID 72679887) is N-[[4-(4-fluorophenyl)morpholin-3-yl]methyl]-1-(3-methoxyphenyl)ethanamine.
What is the SMILES notation for N-[[4-(4-fluorophenyl)morpholin-3-yl]methyl]-1-(3-methoxyphenyl)ethanamine?
The canonical SMILES for N-[[4-(4-fluorophenyl)morpholin-3-yl]methyl]-1-(3-methoxyphenyl)ethanamine is COc1cccc(C(C)NCC2COCCN2c2ccc(F)cc2)c1.
What is the InChIKey of N-[[4-(4-fluorophenyl)morpholin-3-yl]methyl]-1-(3-methoxyphenyl)ethanamine?
The InChIKey is HFGLAZYOORRQAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25FN2O2/c1-15(16-4-3-5-20(12-16)24-2)22-13-19-14-25-11-10-23(19)18-8-6-17(21)7-9-18/h3-9,12,15,19,22H,10-11,13-14H2,1-2H3.
What are the key properties of N-[[4-(4-fluorophenyl)morpholin-3-yl]methyl]-1-(3-methoxyphenyl)ethanamine?
N-[[4-(4-fluorophenyl)morpholin-3-yl]methyl]-1-(3-methoxyphenyl)ethanamine has a molecular weight of 344.43 g/mol, XLogP of 3.39, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(4-fluorophenyl)morpholin-3-yl]methyl]-1-(3-methoxyphenyl)ethanamine is sourced from PubChem (CID 72679887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).