1-(2,5-difluorophenyl)-2-methyl-2-morpholin-4-ylbutan-1-amine

C15H22F2N2O — CID 79065702

IUPAC1-(2,5-difluorophenyl)-2-methyl-2-morpholin-4-ylbutan-1-amine
SMILESCCC(C)(C(N)c1cc(F)ccc1F)N1CCOCC1
InChIInChI=1S/C15H22F2N2O/c1-3-15(2,19-6-8-20-9-7-19)14(18)12-10-11(16)4-5-13(12)17/h4-5,10,14H,3,6-9,18H2,1-2H3
InChIKeyAZLZWSMYNZIUMA-UHFFFAOYSA-N
MW284.35 g/mol
LogP2.47
Rot. Bonds4

About 1-(2,5-difluorophenyl)-2-methyl-2-morpholin-4-ylbutan-1-amine

1-(2,5-difluorophenyl)-2-methyl-2-morpholin-4-ylbutan-1-amine (PubChem CID 79065702) has the molecular formula C15H22F2N2O and a molecular weight of 284.35 g/mol. Its IUPAC name is 1-(2,5-difluorophenyl)-2-methyl-2-morpholin-4-ylbutan-1-amine.

Molecular Properties

Compound Name1-(2,5-difluorophenyl)-2-methyl-2-morpholin-4-ylbutan-1-amine
PubChem CID79065702
Molecular FormulaC15H22F2N2O
Molecular Weight284.35 g/mol
Exact Mass284.17
IUPAC Name1-(2,5-difluorophenyl)-2-methyl-2-morpholin-4-ylbutan-1-amine
SMILESCCC(C)(C(N)c1cc(F)ccc1F)N1CCOCC1
InChIInChI=1S/C15H22F2N2O/c1-3-15(2,19-6-8-20-9-7-19)14(18)12-10-11(16)4-5-13(12)17/h4-5,10,14H,3,6-9,18H2,1-2H3
InChIKeyAZLZWSMYNZIUMA-UHFFFAOYSA-N
XLogP2.47
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.35
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,5-difluorophenyl)-2-methyl-2-piperidin-1-ylbutan-1-amine
CID 79065070
2-methyl-2-morpholin-4-yl-1-(2,3,4-trifluorophenyl)butan-1-amine
CID 79057610
1-(2-chloro-5-fluorophenyl)-2-methyl-2-pyrrolidin-1-ylbutan-1-amine
CID 105395170
1-(2-ethoxyphenyl)-2-methyl-2-morpholin-4-ylbutan-1-amine
CID 79057615
1-(4-ethylphenyl)-2-methyl-2-morpholin-4-ylbutan-1-amine
CID 79065259
2-methyl-2-pyrrolidin-1-yl-1-(2,3,4-trifluorophenyl)butan-1-amine
CID 79068641
1-(2-fluorophenyl)-2-methyl-2-pyrrolidin-1-ylbutan-1-amine
CID 79068482
1-(4-bromo-2-fluorophenyl)-3-methyl-3-morpholin-4-ylpentan-2-amine
CID 79057613
1-(2,5-difluorophenyl)-2-N,2-N,2-triethylbutane-1,2-diamine
CID 79062206
3-(2,5-difluorophenyl)-3-morpholin-4-ylpropan-1-amine
CID 69312368
1-(3,4-difluorophenyl)-2-methyl-2-morpholin-4-ylpropan-1-amine
CID 79051908
3-methyl-3-morpholin-4-yl-1-phenylpentan-2-amine
CID 79065628

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-difluorophenyl)-2-methyl-2-morpholin-4-ylbutan-1-amine?
The IUPAC name of 1-(2,5-difluorophenyl)-2-methyl-2-morpholin-4-ylbutan-1-amine (CID 79065702) is 1-(2,5-difluorophenyl)-2-methyl-2-morpholin-4-ylbutan-1-amine.
What is the SMILES notation for 1-(2,5-difluorophenyl)-2-methyl-2-morpholin-4-ylbutan-1-amine?
The canonical SMILES for 1-(2,5-difluorophenyl)-2-methyl-2-morpholin-4-ylbutan-1-amine is CCC(C)(C(N)c1cc(F)ccc1F)N1CCOCC1.
What is the InChIKey of 1-(2,5-difluorophenyl)-2-methyl-2-morpholin-4-ylbutan-1-amine?
The InChIKey is AZLZWSMYNZIUMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22F2N2O/c1-3-15(2,19-6-8-20-9-7-19)14(18)12-10-11(16)4-5-13(12)17/h4-5,10,14H,3,6-9,18H2,1-2H3.
What are the key properties of 1-(2,5-difluorophenyl)-2-methyl-2-morpholin-4-ylbutan-1-amine?
1-(2,5-difluorophenyl)-2-methyl-2-morpholin-4-ylbutan-1-amine has a molecular weight of 284.35 g/mol, XLogP of 2.47, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-difluorophenyl)-2-methyl-2-morpholin-4-ylbutan-1-amine is sourced from PubChem (CID 79065702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).