[4-(3-amino-1,5-dimethylpyrazol-4-yl)sulfonyl-6-methylmorpholin-2-yl]methanol

C11H20N4O4S — CID 102931816

IUPAC[4-(3-amino-1,5-dimethylpyrazol-4-yl)sulfonyl-6-methylmorpholin-2-yl]methanol
SMILESCc1c(S(=O)(=O)N2CC(C)OC(CO)C2)c(N)nn1C
InChIInChI=1S/C11H20N4O4S/c1-7-4-15(5-9(6-16)19-7)20(17,18)10-8(2)14(3)13-11(10)12/h7,9,16H,4-6H2,1-3H3,(H2,12,13)
InChIKeyRFNWMOJSYXRTRZ-UHFFFAOYSA-N
MW304.37 g/mol
LogP-0.92
Rot. Bonds3

About [4-(3-amino-1,5-dimethylpyrazol-4-yl)sulfonyl-6-methylmorpholin-2-yl]methanol

[4-(3-amino-1,5-dimethylpyrazol-4-yl)sulfonyl-6-methylmorpholin-2-yl]methanol (PubChem CID 102931816) has the molecular formula C11H20N4O4S and a molecular weight of 304.37 g/mol. Its IUPAC name is [4-(3-amino-1,5-dimethylpyrazol-4-yl)sulfonyl-6-methylmorpholin-2-yl]methanol.

Molecular Properties

Compound Name[4-(3-amino-1,5-dimethylpyrazol-4-yl)sulfonyl-6-methylmorpholin-2-yl]methanol
PubChem CID102931816
Molecular FormulaC11H20N4O4S
Molecular Weight304.37 g/mol
Exact Mass304.12
IUPAC Name[4-(3-amino-1,5-dimethylpyrazol-4-yl)sulfonyl-6-methylmorpholin-2-yl]methanol
SMILESCc1c(S(=O)(=O)N2CC(C)OC(CO)C2)c(N)nn1C
InChIInChI=1S/C11H20N4O4S/c1-7-4-15(5-9(6-16)19-7)20(17,18)10-8(2)14(3)13-11(10)12/h7,9,16H,4-6H2,1-3H3,(H2,12,13)
InChIKeyRFNWMOJSYXRTRZ-UHFFFAOYSA-N
XLogP-0.92
TPSA110.68 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.37
LogP ≤ 5-0.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

3-amino-N-(2-hydroxyethyl)-1,5-dimethyl-N-(2,2,2-trifluoroethyl)pyrazole-4-sulfonamide
CID 105358606
3-amino-N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-1,5-dimethylpyrazole-4-sulfonamide
CID 107478051
[4-(1,3,5-Trimethylpyrazol-4-yl)sulfonylmorpholin-2-yl]methanol
CID 81219252
[5-Methyl-4-(1,3,5-trimethylpyrazol-4-yl)sulfonylmorpholin-2-yl]methanol
CID 81219818
5-amino-1,3-dimethyl-N-(3-propan-2-yloxypropyl)pyrazole-4-sulfonamide
CID 82460008
5-amino-1,3-dimethyl-N-(2-morpholin-4-ylethyl)pyrazole-4-sulfonamide
CID 82460031
1,5-Dimethyl-4-(2,2,6,6-tetramethylmorpholin-4-yl)sulfonylpyrazol-3-amine
CID 102742714
3-amino-N-cyclobutyl-N-(3-hydroxypropyl)-1,5-dimethylpyrazole-4-sulfonamide
CID 102859017
3-amino-N-cyclobutyl-N-(2-hydroxyethyl)-1,5-dimethylpyrazole-4-sulfonamide
CID 102859130
[6-Methyl-4-(1,3,5-trimethylpyrazol-4-yl)sulfonylmorpholin-2-yl]methanol
CID 102934932
1-(3-Amino-1,5-dimethylpyrazol-4-yl)sulfonyl-4-methylpiperidin-3-ol
CID 102955129
4-(3-Methoxy-4-methylpiperidin-1-yl)sulfonyl-1,5-dimethylpyrazol-3-amine
CID 102955223

Frequently Asked Questions

What is the IUPAC name of [4-(3-amino-1,5-dimethylpyrazol-4-yl)sulfonyl-6-methylmorpholin-2-yl]methanol?
The IUPAC name of [4-(3-amino-1,5-dimethylpyrazol-4-yl)sulfonyl-6-methylmorpholin-2-yl]methanol (CID 102931816) is [4-(3-amino-1,5-dimethylpyrazol-4-yl)sulfonyl-6-methylmorpholin-2-yl]methanol.
What is the SMILES notation for [4-(3-amino-1,5-dimethylpyrazol-4-yl)sulfonyl-6-methylmorpholin-2-yl]methanol?
The canonical SMILES for [4-(3-amino-1,5-dimethylpyrazol-4-yl)sulfonyl-6-methylmorpholin-2-yl]methanol is Cc1c(S(=O)(=O)N2CC(C)OC(CO)C2)c(N)nn1C.
What is the InChIKey of [4-(3-amino-1,5-dimethylpyrazol-4-yl)sulfonyl-6-methylmorpholin-2-yl]methanol?
The InChIKey is RFNWMOJSYXRTRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O4S/c1-7-4-15(5-9(6-16)19-7)20(17,18)10-8(2)14(3)13-11(10)12/h7,9,16H,4-6H2,1-3H3,(H2,12,13).
What are the key properties of [4-(3-amino-1,5-dimethylpyrazol-4-yl)sulfonyl-6-methylmorpholin-2-yl]methanol?
[4-(3-amino-1,5-dimethylpyrazol-4-yl)sulfonyl-6-methylmorpholin-2-yl]methanol has a molecular weight of 304.37 g/mol, XLogP of -0.92, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(3-amino-1,5-dimethylpyrazol-4-yl)sulfonyl-6-methylmorpholin-2-yl]methanol is sourced from PubChem (CID 102931816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).