[4-(difluoromethylsulfonyl)-5-methylmorpholin-2-yl]methanamine

C7H14F2N2O3S — CID 81216979

IUPAC[4-(difluoromethylsulfonyl)-5-methylmorpholin-2-yl]methanamine
SMILESCC1COC(CN)CN1S(=O)(=O)C(F)F
InChIInChI=1S/C7H14F2N2O3S/c1-5-4-14-6(2-10)3-11(5)15(12,13)7(8)9/h5-7H,2-4,10H2,1H3
InChIKeyOVEDJFAZRZSRIZ-UHFFFAOYSA-N
MW244.26 g/mol
LogP-0.41
Rot. Bonds3

About [4-(difluoromethylsulfonyl)-5-methylmorpholin-2-yl]methanamine

[4-(difluoromethylsulfonyl)-5-methylmorpholin-2-yl]methanamine (PubChem CID 81216979) has the molecular formula C7H14F2N2O3S and a molecular weight of 244.26 g/mol. Its IUPAC name is [4-(difluoromethylsulfonyl)-5-methylmorpholin-2-yl]methanamine.

Molecular Properties

Compound Name[4-(difluoromethylsulfonyl)-5-methylmorpholin-2-yl]methanamine
PubChem CID81216979
Molecular FormulaC7H14F2N2O3S
Molecular Weight244.26 g/mol
Exact Mass244.07
IUPAC Name[4-(difluoromethylsulfonyl)-5-methylmorpholin-2-yl]methanamine
SMILESCC1COC(CN)CN1S(=O)(=O)C(F)F
InChIInChI=1S/C7H14F2N2O3S/c1-5-4-14-6(2-10)3-11(5)15(12,13)7(8)9/h5-7H,2-4,10H2,1H3
InChIKeyOVEDJFAZRZSRIZ-UHFFFAOYSA-N
XLogP-0.41
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.26
LogP ≤ 5-0.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(aminomethyl)-5-methylmorpholine-4-sulfonamide
CID 114959630
[5-methyl-4-(methylsulfonylmethylsulfonyl)morpholin-2-yl]methanamine
CID 82842298
[5-methyl-4-(4,4,4-trifluorobutylsulfonyl)morpholin-2-yl]methanamine
CID 83060013
(5-methyl-4-propan-2-ylsulfonylmorpholin-2-yl)methanol
CID 81219426
[5-methyl-4-(oxolan-2-ylmethylsulfonyl)morpholin-2-yl]methanamine
CID 81217702
[4-(3,4-difluorophenyl)sulfonyl-5-methylmorpholin-2-yl]methanamine
CID 81217308
[4-(2,5-difluorophenyl)sulfonyl-5-methylmorpholin-2-yl]methanamine
CID 81218450
[5-methyl-4-(1H-pyrazol-5-ylsulfonyl)morpholin-2-yl]methanamine
CID 102694127
[5-methyl-4-(2-propan-2-yloxyethyl)morpholin-2-yl]methanamine
CID 81217007
[(2S,3S)-1-[(2R,5R)-2,5-dimethylmorpholin-4-yl]sulfonyl-3-methylpiperidin-2-yl]methanamine
CID 125145965
2-[2-(aminomethyl)-5-methylmorpholin-4-yl]butanamide
CID 81217216
[5-methyl-4-(4,4,4-trifluorobutyl)morpholin-2-yl]methanamine
CID 115518530

Frequently Asked Questions

What is the IUPAC name of [4-(difluoromethylsulfonyl)-5-methylmorpholin-2-yl]methanamine?
The IUPAC name of [4-(difluoromethylsulfonyl)-5-methylmorpholin-2-yl]methanamine (CID 81216979) is [4-(difluoromethylsulfonyl)-5-methylmorpholin-2-yl]methanamine.
What is the SMILES notation for [4-(difluoromethylsulfonyl)-5-methylmorpholin-2-yl]methanamine?
The canonical SMILES for [4-(difluoromethylsulfonyl)-5-methylmorpholin-2-yl]methanamine is CC1COC(CN)CN1S(=O)(=O)C(F)F.
What is the InChIKey of [4-(difluoromethylsulfonyl)-5-methylmorpholin-2-yl]methanamine?
The InChIKey is OVEDJFAZRZSRIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14F2N2O3S/c1-5-4-14-6(2-10)3-11(5)15(12,13)7(8)9/h5-7H,2-4,10H2,1H3.
What are the key properties of [4-(difluoromethylsulfonyl)-5-methylmorpholin-2-yl]methanamine?
[4-(difluoromethylsulfonyl)-5-methylmorpholin-2-yl]methanamine has a molecular weight of 244.26 g/mol, XLogP of -0.41, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(difluoromethylsulfonyl)-5-methylmorpholin-2-yl]methanamine is sourced from PubChem (CID 81216979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).