1-(2-hydrazinylpyrimidin-5-yl)sulfonyl-3-methylpyrrolidin-3-ol

C9H15N5O3S — CID 103356611

IUPAC1-(2-hydrazinylpyrimidin-5-yl)sulfonyl-3-methylpyrrolidin-3-ol
SMILESCC1(O)CCN(S(=O)(=O)c2cnc(NN)nc2)C1
InChIInChI=1S/C9H15N5O3S/c1-9(15)2-3-14(6-9)18(16,17)7-4-11-8(13-10)12-5-7/h4-5,15H,2-3,6,10H2,1H3,(H,11,12,13)
InChIKeyMNFFCGBMTDETJV-UHFFFAOYSA-N
MW273.32 g/mol
LogP-1.09
Rot. Bonds3

About 1-(2-hydrazinylpyrimidin-5-yl)sulfonyl-3-methylpyrrolidin-3-ol

1-(2-hydrazinylpyrimidin-5-yl)sulfonyl-3-methylpyrrolidin-3-ol (PubChem CID 103356611) has the molecular formula C9H15N5O3S and a molecular weight of 273.32 g/mol. Its IUPAC name is 1-(2-hydrazinylpyrimidin-5-yl)sulfonyl-3-methylpyrrolidin-3-ol.

Molecular Properties

Compound Name1-(2-hydrazinylpyrimidin-5-yl)sulfonyl-3-methylpyrrolidin-3-ol
PubChem CID103356611
Molecular FormulaC9H15N5O3S
Molecular Weight273.32 g/mol
Exact Mass273.09
IUPAC Name1-(2-hydrazinylpyrimidin-5-yl)sulfonyl-3-methylpyrrolidin-3-ol
SMILESCC1(O)CCN(S(=O)(=O)c2cnc(NN)nc2)C1
InChIInChI=1S/C9H15N5O3S/c1-9(15)2-3-14(6-9)18(16,17)7-4-11-8(13-10)12-5-7/h4-5,15H,2-3,6,10H2,1H3,(H,11,12,13)
InChIKeyMNFFCGBMTDETJV-UHFFFAOYSA-N
XLogP-1.09
TPSA121.44 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.32
LogP ≤ 5-1.09
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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Frequently Asked Questions

What is the IUPAC name of 1-(2-hydrazinylpyrimidin-5-yl)sulfonyl-3-methylpyrrolidin-3-ol?
The IUPAC name of 1-(2-hydrazinylpyrimidin-5-yl)sulfonyl-3-methylpyrrolidin-3-ol (CID 103356611) is 1-(2-hydrazinylpyrimidin-5-yl)sulfonyl-3-methylpyrrolidin-3-ol.
What is the SMILES notation for 1-(2-hydrazinylpyrimidin-5-yl)sulfonyl-3-methylpyrrolidin-3-ol?
The canonical SMILES for 1-(2-hydrazinylpyrimidin-5-yl)sulfonyl-3-methylpyrrolidin-3-ol is CC1(O)CCN(S(=O)(=O)c2cnc(NN)nc2)C1.
What is the InChIKey of 1-(2-hydrazinylpyrimidin-5-yl)sulfonyl-3-methylpyrrolidin-3-ol?
The InChIKey is MNFFCGBMTDETJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N5O3S/c1-9(15)2-3-14(6-9)18(16,17)7-4-11-8(13-10)12-5-7/h4-5,15H,2-3,6,10H2,1H3,(H,11,12,13).
What are the key properties of 1-(2-hydrazinylpyrimidin-5-yl)sulfonyl-3-methylpyrrolidin-3-ol?
1-(2-hydrazinylpyrimidin-5-yl)sulfonyl-3-methylpyrrolidin-3-ol has a molecular weight of 273.32 g/mol, XLogP of -1.09, 3 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-hydrazinylpyrimidin-5-yl)sulfonyl-3-methylpyrrolidin-3-ol is sourced from PubChem (CID 103356611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).