[4-(2,2,6,6-tetramethylmorpholin-4-yl)sulfonylphenyl]methanamine

C15H24N2O3S — CID 102743555

IUPAC[4-(2,2,6,6-tetramethylmorpholin-4-yl)sulfonylphenyl]methanamine
SMILESCC1(C)CN(S(=O)(=O)c2ccc(CN)cc2)CC(C)(C)O1
InChIInChI=1S/C15H24N2O3S/c1-14(2)10-17(11-15(3,4)20-14)21(18,19)13-7-5-12(9-16)6-8-13/h5-8H,9-11,16H2,1-4H3
InChIKeyBQNYUYQVBJNPSB-UHFFFAOYSA-N
MW312.44 g/mol
LogP1.72
Rot. Bonds3

About [4-(2,2,6,6-tetramethylmorpholin-4-yl)sulfonylphenyl]methanamine

[4-(2,2,6,6-tetramethylmorpholin-4-yl)sulfonylphenyl]methanamine (PubChem CID 102743555) has the molecular formula C15H24N2O3S and a molecular weight of 312.44 g/mol. Its IUPAC name is [4-(2,2,6,6-tetramethylmorpholin-4-yl)sulfonylphenyl]methanamine.

Molecular Properties

Compound Name[4-(2,2,6,6-tetramethylmorpholin-4-yl)sulfonylphenyl]methanamine
PubChem CID102743555
Molecular FormulaC15H24N2O3S
Molecular Weight312.44 g/mol
Exact Mass312.15
IUPAC Name[4-(2,2,6,6-tetramethylmorpholin-4-yl)sulfonylphenyl]methanamine
SMILESCC1(C)CN(S(=O)(=O)c2ccc(CN)cc2)CC(C)(C)O1
InChIInChI=1S/C15H24N2O3S/c1-14(2)10-17(11-15(3,4)20-14)21(18,19)13-7-5-12(9-16)6-8-13/h5-8H,9-11,16H2,1-4H3
InChIKeyBQNYUYQVBJNPSB-UHFFFAOYSA-N
XLogP1.72
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.44
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2,2,6,6-tetramethylmorpholin-4-yl)sulfonylphenol
CID 102744853
4-(2,2,6,6-tetramethylmorpholin-4-yl)sulfonylbenzonitrile
CID 102743888
[4-methyl-3-(2,2,6,6-tetramethylmorpholin-4-yl)sulfonylthiophen-2-yl]methanamine
CID 102755178
[4-(4-propylpiperidin-1-yl)sulfonylphenyl]methanamine
CID 62204890
[4-[4-(2-methylpropyl)piperazin-1-yl]sulfonylphenyl]methanamine
CID 62777478
4-[4-(2-chloroethyl)phenyl]sulfonyl-2,2-dimethylmorpholine
CID 43662638
1-[4-(aminomethyl)phenyl]sulfonyl-4-methylpiperidin-3-ol
CID 102956939
[4-[(4-tert-butyl-3,6-dihydro-2H-pyridin-1-yl)sulfonyl]phenyl]methanamine
CID 114460479
N-methyl-5-(2,2,6,6-tetramethylmorpholin-4-yl)sulfonylpyrimidin-2-amine
CID 102745579
[4-[(1-methyl-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrol-5-yl)sulfonyl]phenyl]methanamine
CID 154436586
3-(2,2,6,6-tetramethylmorpholin-4-yl)sulfonylpyridin-4-amine
CID 102745571
[4-(4-cyclohexylpiperazin-1-yl)sulfonylphenyl]methanamine
CID 154513056

Frequently Asked Questions

What is the IUPAC name of [4-(2,2,6,6-tetramethylmorpholin-4-yl)sulfonylphenyl]methanamine?
The IUPAC name of [4-(2,2,6,6-tetramethylmorpholin-4-yl)sulfonylphenyl]methanamine (CID 102743555) is [4-(2,2,6,6-tetramethylmorpholin-4-yl)sulfonylphenyl]methanamine.
What is the SMILES notation for [4-(2,2,6,6-tetramethylmorpholin-4-yl)sulfonylphenyl]methanamine?
The canonical SMILES for [4-(2,2,6,6-tetramethylmorpholin-4-yl)sulfonylphenyl]methanamine is CC1(C)CN(S(=O)(=O)c2ccc(CN)cc2)CC(C)(C)O1.
What is the InChIKey of [4-(2,2,6,6-tetramethylmorpholin-4-yl)sulfonylphenyl]methanamine?
The InChIKey is BQNYUYQVBJNPSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3S/c1-14(2)10-17(11-15(3,4)20-14)21(18,19)13-7-5-12(9-16)6-8-13/h5-8H,9-11,16H2,1-4H3.
What are the key properties of [4-(2,2,6,6-tetramethylmorpholin-4-yl)sulfonylphenyl]methanamine?
[4-(2,2,6,6-tetramethylmorpholin-4-yl)sulfonylphenyl]methanamine has a molecular weight of 312.44 g/mol, XLogP of 1.72, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2,2,6,6-tetramethylmorpholin-4-yl)sulfonylphenyl]methanamine is sourced from PubChem (CID 102743555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).