1-[1-[(2-hydrazinyl-3-pyridinyl)sulfonyl]pyrrolidin-3-yl]ethanol

C11H18N4O3S — CID 112626122

IUPAC1-[1-[(2-hydrazinyl-3-pyridinyl)sulfonyl]pyrrolidin-3-yl]ethanol
SMILESCC(O)C1CCN(S(=O)(=O)c2cccnc2NN)C1
InChIInChI=1S/C11H18N4O3S/c1-8(16)9-4-6-15(7-9)19(17,18)10-3-2-5-13-11(10)14-12/h2-3,5,8-9,16H,4,6-7,12H2,1H3,(H,13,14)
InChIKeyQXXIULKABAWEGD-UHFFFAOYSA-N
MW286.36 g/mol
LogP-0.24
Rot. Bonds4

About 1-[1-[(2-hydrazinyl-3-pyridinyl)sulfonyl]pyrrolidin-3-yl]ethanol

1-[1-[(2-hydrazinyl-3-pyridinyl)sulfonyl]pyrrolidin-3-yl]ethanol (PubChem CID 112626122) has the molecular formula C11H18N4O3S and a molecular weight of 286.36 g/mol. Its IUPAC name is 1-[1-[(2-hydrazinyl-3-pyridinyl)sulfonyl]pyrrolidin-3-yl]ethanol.

Molecular Properties

Compound Name1-[1-[(2-hydrazinyl-3-pyridinyl)sulfonyl]pyrrolidin-3-yl]ethanol
PubChem CID112626122
Molecular FormulaC11H18N4O3S
Molecular Weight286.36 g/mol
Exact Mass286.11
IUPAC Name1-[1-[(2-hydrazinyl-3-pyridinyl)sulfonyl]pyrrolidin-3-yl]ethanol
SMILESCC(O)C1CCN(S(=O)(=O)c2cccnc2NN)C1
InChIInChI=1S/C11H18N4O3S/c1-8(16)9-4-6-15(7-9)19(17,18)10-3-2-5-13-11(10)14-12/h2-3,5,8-9,16H,4,6-7,12H2,1H3,(H,13,14)
InChIKeyQXXIULKABAWEGD-UHFFFAOYSA-N
XLogP-0.24
TPSA108.55 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.36
LogP ≤ 5-0.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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

1-[(2-hydrazinyl-3-pyridinyl)sulfonyl]-N,N-dimethylpyrrolidin-3-amine
CID 63541851
N,N-diethyl-1-[(2-hydrazinyl-3-pyridinyl)sulfonyl]pyrrolidin-3-amine
CID 63539689
1-[(2-hydrazinyl-3-pyridinyl)sulfonyl]pyrrolidine-3,4-diol
CID 106670062
1-[1-(2-methylphenyl)sulfonylpyrrolidin-3-yl]ethanol
CID 112627615
3-[4-(1-hydroxyethyl)piperidin-1-yl]sulfonylpyridine-2-carbothioamide
CID 106835967
[3-(4-methylsulfonylpiperazin-1-yl)sulfonyl-2-pyridinyl]hydrazine
CID 62992566
3-(3-propan-2-ylpyrrolidin-1-yl)sulfonylpyridine-2-carbothioamide
CID 106597808
1-[1-[(5-bromo-2-hydrazinyl-3-pyridinyl)sulfonyl]piperidin-4-yl]ethanol
CID 106836374
1-[[2-(ethylamino)-3-pyridinyl]sulfonyl]-4-methylpiperidin-3-ol
CID 102964473
[3-[4-(cyclopropylmethyl)piperazin-1-yl]sulfonyl-2-pyridinyl]hydrazine
CID 61442880
3-ethyl-4-[(2-hydrazinyl-3-pyridinyl)sulfonyl]piperazin-2-one
CID 63603348
[3-(2-ethylpyrrolidin-1-yl)sulfonyl-2-pyridinyl]hydrazine
CID 60974921

Frequently Asked Questions

What is the IUPAC name of 1-[1-[(2-hydrazinyl-3-pyridinyl)sulfonyl]pyrrolidin-3-yl]ethanol?
The IUPAC name of 1-[1-[(2-hydrazinyl-3-pyridinyl)sulfonyl]pyrrolidin-3-yl]ethanol (CID 112626122) is 1-[1-[(2-hydrazinyl-3-pyridinyl)sulfonyl]pyrrolidin-3-yl]ethanol.
What is the SMILES notation for 1-[1-[(2-hydrazinyl-3-pyridinyl)sulfonyl]pyrrolidin-3-yl]ethanol?
The canonical SMILES for 1-[1-[(2-hydrazinyl-3-pyridinyl)sulfonyl]pyrrolidin-3-yl]ethanol is CC(O)C1CCN(S(=O)(=O)c2cccnc2NN)C1.
What is the InChIKey of 1-[1-[(2-hydrazinyl-3-pyridinyl)sulfonyl]pyrrolidin-3-yl]ethanol?
The InChIKey is QXXIULKABAWEGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O3S/c1-8(16)9-4-6-15(7-9)19(17,18)10-3-2-5-13-11(10)14-12/h2-3,5,8-9,16H,4,6-7,12H2,1H3,(H,13,14).
What are the key properties of 1-[1-[(2-hydrazinyl-3-pyridinyl)sulfonyl]pyrrolidin-3-yl]ethanol?
1-[1-[(2-hydrazinyl-3-pyridinyl)sulfonyl]pyrrolidin-3-yl]ethanol has a molecular weight of 286.36 g/mol, XLogP of -0.24, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[(2-hydrazinyl-3-pyridinyl)sulfonyl]pyrrolidin-3-yl]ethanol is sourced from PubChem (CID 112626122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).