[5-[1-(benzenesulfonyl)indol-5-yl]-3-fluoro-2-pyridinyl]hydrazine

C19H15FN4O2S — CID 163365939

IUPAC[5-[1-(benzenesulfonyl)indol-5-yl]-3-fluoro-2-pyridinyl]hydrazine
SMILESNNc1ncc(-c2ccc3c(ccn3S(=O)(=O)c3ccccc3)c2)cc1F
InChIInChI=1S/C19H15FN4O2S/c20-17-11-15(12-22-19(17)23-21)13-6-7-18-14(10-13)8-9-24(18)27(25,26)16-4-2-1-3-5-16/h1-12H,21H2,(H,22,23)
InChIKeyJVCFABBQCJHBIC-UHFFFAOYSA-N
MW382.42 g/mol
LogP3.37
Rot. Bonds4

About [5-[1-(benzenesulfonyl)indol-5-yl]-3-fluoro-2-pyridinyl]hydrazine

[5-[1-(benzenesulfonyl)indol-5-yl]-3-fluoro-2-pyridinyl]hydrazine (PubChem CID 163365939) has the molecular formula C19H15FN4O2S and a molecular weight of 382.42 g/mol. Its IUPAC name is [5-[1-(benzenesulfonyl)indol-5-yl]-3-fluoro-2-pyridinyl]hydrazine.

Molecular Properties

Compound Name[5-[1-(benzenesulfonyl)indol-5-yl]-3-fluoro-2-pyridinyl]hydrazine
PubChem CID163365939
Molecular FormulaC19H15FN4O2S
Molecular Weight382.42 g/mol
Exact Mass382.09
IUPAC Name[5-[1-(benzenesulfonyl)indol-5-yl]-3-fluoro-2-pyridinyl]hydrazine
SMILESNNc1ncc(-c2ccc3c(ccn3S(=O)(=O)c3ccccc3)c2)cc1F
InChIInChI=1S/C19H15FN4O2S/c20-17-11-15(12-22-19(17)23-21)13-6-7-18-14(10-13)8-9-24(18)27(25,26)16-4-2-1-3-5-16/h1-12H,21H2,(H,22,23)
InChIKeyJVCFABBQCJHBIC-UHFFFAOYSA-N
XLogP3.37
TPSA90.01 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.42
LogP ≤ 53.37
H-Bond Donors ≤ 52
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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Frequently Asked Questions

What is the IUPAC name of [5-[1-(benzenesulfonyl)indol-5-yl]-3-fluoro-2-pyridinyl]hydrazine?
The IUPAC name of [5-[1-(benzenesulfonyl)indol-5-yl]-3-fluoro-2-pyridinyl]hydrazine (CID 163365939) is [5-[1-(benzenesulfonyl)indol-5-yl]-3-fluoro-2-pyridinyl]hydrazine.
What is the SMILES notation for [5-[1-(benzenesulfonyl)indol-5-yl]-3-fluoro-2-pyridinyl]hydrazine?
The canonical SMILES for [5-[1-(benzenesulfonyl)indol-5-yl]-3-fluoro-2-pyridinyl]hydrazine is NNc1ncc(-c2ccc3c(ccn3S(=O)(=O)c3ccccc3)c2)cc1F.
What is the InChIKey of [5-[1-(benzenesulfonyl)indol-5-yl]-3-fluoro-2-pyridinyl]hydrazine?
The InChIKey is JVCFABBQCJHBIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15FN4O2S/c20-17-11-15(12-22-19(17)23-21)13-6-7-18-14(10-13)8-9-24(18)27(25,26)16-4-2-1-3-5-16/h1-12H,21H2,(H,22,23).
What are the key properties of [5-[1-(benzenesulfonyl)indol-5-yl]-3-fluoro-2-pyridinyl]hydrazine?
[5-[1-(benzenesulfonyl)indol-5-yl]-3-fluoro-2-pyridinyl]hydrazine has a molecular weight of 382.42 g/mol, XLogP of 3.37, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[1-(benzenesulfonyl)indol-5-yl]-3-fluoro-2-pyridinyl]hydrazine is sourced from PubChem (CID 163365939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).