[5-(1,3-dihydroisoindol-2-ylsulfonyl)-2-pyridinyl]hydrazine

C13H14N4O2S — CID 62231833

IUPAC[5-(1,3-dihydroisoindol-2-ylsulfonyl)-2-pyridinyl]hydrazine
SMILESNNc1ccc(S(=O)(=O)N2Cc3ccccc3C2)cn1
InChIInChI=1S/C13H14N4O2S/c14-16-13-6-5-12(7-15-13)20(18,19)17-8-10-3-1-2-4-11(10)9-17/h1-7H,8-9,14H2,(H,15,16)
InChIKeyVHBLPTDDZDXWFZ-UHFFFAOYSA-N
MW290.35 g/mol
LogP1.07
Rot. Bonds3

About [5-(1,3-dihydroisoindol-2-ylsulfonyl)-2-pyridinyl]hydrazine

[5-(1,3-dihydroisoindol-2-ylsulfonyl)-2-pyridinyl]hydrazine (PubChem CID 62231833) has the molecular formula C13H14N4O2S and a molecular weight of 290.35 g/mol. Its IUPAC name is [5-(1,3-dihydroisoindol-2-ylsulfonyl)-2-pyridinyl]hydrazine.

Molecular Properties

Compound Name[5-(1,3-dihydroisoindol-2-ylsulfonyl)-2-pyridinyl]hydrazine
PubChem CID62231833
Molecular FormulaC13H14N4O2S
Molecular Weight290.35 g/mol
Exact Mass290.08
IUPAC Name[5-(1,3-dihydroisoindol-2-ylsulfonyl)-2-pyridinyl]hydrazine
SMILESNNc1ccc(S(=O)(=O)N2Cc3ccccc3C2)cn1
InChIInChI=1S/C13H14N4O2S/c14-16-13-6-5-12(7-15-13)20(18,19)17-8-10-3-1-2-4-11(10)9-17/h1-7H,8-9,14H2,(H,15,16)
InChIKeyVHBLPTDDZDXWFZ-UHFFFAOYSA-N
XLogP1.07
TPSA88.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.35
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

4-[(6-hydrazinyl-3-pyridinyl)sulfonyl]piperazine-2,6-dione
CID 66063379
[5-(4,4-dimethylpiperidin-1-yl)sulfonyl-2-pyridinyl]hydrazine
CID 62932708
5-(1,3-dihydroisoindol-2-ylsulfonyl)-N-methylpyrimidin-2-amine
CID 62231057
1-[(6-hydrazinyl-3-pyridinyl)sulfonyl]piperidin-3-ol
CID 61435671
[4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-pyridinyl]hydrazine
CID 61004578
[5-(3-methoxypyrrolidin-1-yl)sulfonyl-2-pyridinyl]hydrazine
CID 103535101
2-[4-[(6-hydrazinyl-3-pyridinyl)sulfonyl]-1,4-diazepan-1-yl]ethanol
CID 107223463
[5-(cyclopropylsulfonimidoyl)-2-pyridinyl]hydrazine
CID 166754683
[5-(cyclopentylsulfonimidoyl)-2-pyridinyl]hydrazine
CID 166754651
4-(1,3-dihydroisoindol-2-ylsulfonyl)-N-methylpyridin-2-amine
CID 62231059
2-(1H-pyrazol-4-ylsulfonyl)-1,3-dihydroisoindole
CID 55049245
5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-methylpyrimidin-2-amine
CID 62149543

Frequently Asked Questions

What is the IUPAC name of [5-(1,3-dihydroisoindol-2-ylsulfonyl)-2-pyridinyl]hydrazine?
The IUPAC name of [5-(1,3-dihydroisoindol-2-ylsulfonyl)-2-pyridinyl]hydrazine (CID 62231833) is [5-(1,3-dihydroisoindol-2-ylsulfonyl)-2-pyridinyl]hydrazine.
What is the SMILES notation for [5-(1,3-dihydroisoindol-2-ylsulfonyl)-2-pyridinyl]hydrazine?
The canonical SMILES for [5-(1,3-dihydroisoindol-2-ylsulfonyl)-2-pyridinyl]hydrazine is NNc1ccc(S(=O)(=O)N2Cc3ccccc3C2)cn1.
What is the InChIKey of [5-(1,3-dihydroisoindol-2-ylsulfonyl)-2-pyridinyl]hydrazine?
The InChIKey is VHBLPTDDZDXWFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4O2S/c14-16-13-6-5-12(7-15-13)20(18,19)17-8-10-3-1-2-4-11(10)9-17/h1-7H,8-9,14H2,(H,15,16).
What are the key properties of [5-(1,3-dihydroisoindol-2-ylsulfonyl)-2-pyridinyl]hydrazine?
[5-(1,3-dihydroisoindol-2-ylsulfonyl)-2-pyridinyl]hydrazine has a molecular weight of 290.35 g/mol, XLogP of 1.07, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(1,3-dihydroisoindol-2-ylsulfonyl)-2-pyridinyl]hydrazine is sourced from PubChem (CID 62231833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).