1-(3,4-difluorophenyl)-2-methyl-2-morpholin-4-ylpropan-1-amine

C14H20F2N2O — CID 79051908

IUPAC1-(3,4-difluorophenyl)-2-methyl-2-morpholin-4-ylpropan-1-amine
SMILESCC(C)(C(N)c1ccc(F)c(F)c1)N1CCOCC1
InChIInChI=1S/C14H20F2N2O/c1-14(2,18-5-7-19-8-6-18)13(17)10-3-4-11(15)12(16)9-10/h3-4,9,13H,5-8,17H2,1-2H3
InChIKeyFBKXMSMRDIAXMX-UHFFFAOYSA-N
MW270.32 g/mol
LogP2.08
Rot. Bonds3

About 1-(3,4-difluorophenyl)-2-methyl-2-morpholin-4-ylpropan-1-amine

1-(3,4-difluorophenyl)-2-methyl-2-morpholin-4-ylpropan-1-amine (PubChem CID 79051908) has the molecular formula C14H20F2N2O and a molecular weight of 270.32 g/mol. Its IUPAC name is 1-(3,4-difluorophenyl)-2-methyl-2-morpholin-4-ylpropan-1-amine.

Molecular Properties

Compound Name1-(3,4-difluorophenyl)-2-methyl-2-morpholin-4-ylpropan-1-amine
PubChem CID79051908
Molecular FormulaC14H20F2N2O
Molecular Weight270.32 g/mol
Exact Mass270.15
IUPAC Name1-(3,4-difluorophenyl)-2-methyl-2-morpholin-4-ylpropan-1-amine
SMILESCC(C)(C(N)c1ccc(F)c(F)c1)N1CCOCC1
InChIInChI=1S/C14H20F2N2O/c1-14(2,18-5-7-19-8-6-18)13(17)10-3-4-11(15)12(16)9-10/h3-4,9,13H,5-8,17H2,1-2H3
InChIKeyFBKXMSMRDIAXMX-UHFFFAOYSA-N
XLogP2.08
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.32
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-2-morpholin-4-yl-1-phenylpropan-1-amine
CID 79051741
1-(4-methoxyphenyl)-2-methyl-2-morpholin-4-ylpropan-1-amine
CID 79051895
1-(3-fluoro-4-methylphenyl)-2-methyl-2-piperidin-1-ylpropan-1-amine
CID 107128890
1-(3-cyclobutylphenyl)-2-methyl-2-morpholin-4-ylpropan-1-amine
CID 114603703
2-(azepan-1-yl)-1-(4-chlorophenyl)-2-methylpropan-1-amine
CID 79050777
1-(2,5-difluorophenyl)-2-methyl-2-morpholin-4-ylbutan-1-amine
CID 79065702
2-(azepan-1-yl)-1-(3-fluorophenyl)-2-methylpropan-1-amine
CID 79051086
1-(3-bromo-2,6-difluorophenyl)-3-methyl-3-morpholin-4-ylbutan-2-amine
CID 106267860
2-(azepan-1-yl)-1-(3,4-dimethylphenyl)-2-methylpropan-1-amine
CID 79051219
2-methyl-2-morpholin-4-yl-1-(2,3,4-trifluorophenyl)butan-1-amine
CID 79057610
1-(3,5-difluorophenyl)-2-methyl-2-piperidin-1-ylpropan-1-amine
CID 79045322
1-(3-fluorophenyl)-2-methyl-2-piperazin-1-ylpropan-1-amine
CID 116946820

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-difluorophenyl)-2-methyl-2-morpholin-4-ylpropan-1-amine?
The IUPAC name of 1-(3,4-difluorophenyl)-2-methyl-2-morpholin-4-ylpropan-1-amine (CID 79051908) is 1-(3,4-difluorophenyl)-2-methyl-2-morpholin-4-ylpropan-1-amine.
What is the SMILES notation for 1-(3,4-difluorophenyl)-2-methyl-2-morpholin-4-ylpropan-1-amine?
The canonical SMILES for 1-(3,4-difluorophenyl)-2-methyl-2-morpholin-4-ylpropan-1-amine is CC(C)(C(N)c1ccc(F)c(F)c1)N1CCOCC1.
What is the InChIKey of 1-(3,4-difluorophenyl)-2-methyl-2-morpholin-4-ylpropan-1-amine?
The InChIKey is FBKXMSMRDIAXMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20F2N2O/c1-14(2,18-5-7-19-8-6-18)13(17)10-3-4-11(15)12(16)9-10/h3-4,9,13H,5-8,17H2,1-2H3.
What are the key properties of 1-(3,4-difluorophenyl)-2-methyl-2-morpholin-4-ylpropan-1-amine?
1-(3,4-difluorophenyl)-2-methyl-2-morpholin-4-ylpropan-1-amine has a molecular weight of 270.32 g/mol, XLogP of 2.08, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,4-difluorophenyl)-2-methyl-2-morpholin-4-ylpropan-1-amine is sourced from PubChem (CID 79051908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).