[4-[(3-hydrazinyl-2-pyridinyl)sulfonyl]-6,6-dimethylmorpholin-2-yl]methanol

C12H20N4O4S — CID 103302124

IUPAC[4-[(3-hydrazinyl-2-pyridinyl)sulfonyl]-6,6-dimethylmorpholin-2-yl]methanol
SMILESCC1(C)CN(S(=O)(=O)c2ncccc2NN)CC(CO)O1
InChIInChI=1S/C12H20N4O4S/c1-12(2)8-16(6-9(7-17)20-12)21(18,19)11-10(15-13)4-3-5-14-11/h3-5,9,15,17H,6-8,13H2,1-2H3
InChIKeyNQOHGUCPJPEFAR-UHFFFAOYSA-N
MW316.38 g/mol
LogP-0.47
Rot. Bonds4

About [4-[(3-hydrazinyl-2-pyridinyl)sulfonyl]-6,6-dimethylmorpholin-2-yl]methanol

[4-[(3-hydrazinyl-2-pyridinyl)sulfonyl]-6,6-dimethylmorpholin-2-yl]methanol (PubChem CID 103302124) has the molecular formula C12H20N4O4S and a molecular weight of 316.38 g/mol. Its IUPAC name is [4-[(3-hydrazinyl-2-pyridinyl)sulfonyl]-6,6-dimethylmorpholin-2-yl]methanol.

Molecular Properties

Compound Name[4-[(3-hydrazinyl-2-pyridinyl)sulfonyl]-6,6-dimethylmorpholin-2-yl]methanol
PubChem CID103302124
Molecular FormulaC12H20N4O4S
Molecular Weight316.38 g/mol
Exact Mass316.12
IUPAC Name[4-[(3-hydrazinyl-2-pyridinyl)sulfonyl]-6,6-dimethylmorpholin-2-yl]methanol
SMILESCC1(C)CN(S(=O)(=O)c2ncccc2NN)CC(CO)O1
InChIInChI=1S/C12H20N4O4S/c1-12(2)8-16(6-9(7-17)20-12)21(18,19)11-10(15-13)4-3-5-14-11/h3-5,9,15,17H,6-8,13H2,1-2H3
InChIKeyNQOHGUCPJPEFAR-UHFFFAOYSA-N
XLogP-0.47
TPSA117.78 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.38
LogP ≤ 5-0.47
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[6,6-dimethyl-4-(2-methylpyrazol-3-yl)sulfonylmorpholin-2-yl]methanol
CID 114779120
[4-[[3-(methylamino)-2-pyridinyl]sulfonyl]morpholin-2-yl]methanol
CID 103306627
[2-(3,4,5-trimethylpiperazin-1-yl)sulfonyl-3-pyridinyl]hydrazine
CID 103302119
[4-(2-methoxyphenyl)sulfonyl-6,6-dimethylmorpholin-2-yl]methanol
CID 114779082
1-[(3-hydrazinyl-2-pyridinyl)sulfonyl]pyrrolidin-3-ol
CID 103301477
[6,6-dimethyl-4-(5-methylthiophen-2-yl)sulfonylmorpholin-2-yl]methanol
CID 114779103
[6,6-dimethyl-4-(3-methylsulfonyl-2-pyridinyl)morpholin-2-yl]methanol
CID 114779341
[2-(4-methylpiperidin-1-yl)sulfonyl-3-pyridinyl]hydrazine
CID 103300836
[4-(4-aminothiophen-2-yl)sulfonyl-6,6-dimethylmorpholin-2-yl]methanol
CID 114776164
[4-(5-chloro-2-methylphenyl)sulfonyl-6,6-dimethylmorpholin-2-yl]methanol
CID 114779155
5-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]sulfonylfuran-2-carboxylic acid
CID 114776516
[2-[4-(methoxymethyl)piperidin-1-yl]sulfonyl-3-pyridinyl]hydrazine
CID 103301600

Frequently Asked Questions

What is the IUPAC name of [4-[(3-hydrazinyl-2-pyridinyl)sulfonyl]-6,6-dimethylmorpholin-2-yl]methanol?
The IUPAC name of [4-[(3-hydrazinyl-2-pyridinyl)sulfonyl]-6,6-dimethylmorpholin-2-yl]methanol (CID 103302124) is [4-[(3-hydrazinyl-2-pyridinyl)sulfonyl]-6,6-dimethylmorpholin-2-yl]methanol.
What is the SMILES notation for [4-[(3-hydrazinyl-2-pyridinyl)sulfonyl]-6,6-dimethylmorpholin-2-yl]methanol?
The canonical SMILES for [4-[(3-hydrazinyl-2-pyridinyl)sulfonyl]-6,6-dimethylmorpholin-2-yl]methanol is CC1(C)CN(S(=O)(=O)c2ncccc2NN)CC(CO)O1.
What is the InChIKey of [4-[(3-hydrazinyl-2-pyridinyl)sulfonyl]-6,6-dimethylmorpholin-2-yl]methanol?
The InChIKey is NQOHGUCPJPEFAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O4S/c1-12(2)8-16(6-9(7-17)20-12)21(18,19)11-10(15-13)4-3-5-14-11/h3-5,9,15,17H,6-8,13H2,1-2H3.
What are the key properties of [4-[(3-hydrazinyl-2-pyridinyl)sulfonyl]-6,6-dimethylmorpholin-2-yl]methanol?
[4-[(3-hydrazinyl-2-pyridinyl)sulfonyl]-6,6-dimethylmorpholin-2-yl]methanol has a molecular weight of 316.38 g/mol, XLogP of -0.47, 4 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(3-hydrazinyl-2-pyridinyl)sulfonyl]-6,6-dimethylmorpholin-2-yl]methanol is sourced from PubChem (CID 103302124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).