2-(hydrazinecarbonyl)-3-phenyl-1H-indole-5-sulfonamide

C15H14N4O3S — CID 14611919

IUPAC2-(hydrazinecarbonyl)-3-phenyl-1H-indole-5-sulfonamide
SMILESNNC(=O)c1[nH]c2ccc(S(N)(=O)=O)cc2c1-c1ccccc1
InChIInChI=1S/C15H14N4O3S/c16-19-15(20)14-13(9-4-2-1-3-5-9)11-8-10(23(17,21)22)6-7-12(11)18-14/h1-8,18H,16H2,(H,19,20)(H2,17,21,22)
InChIKeyPPDLAUCFAOODER-UHFFFAOYSA-N
MW330.37 g/mol
LogP1.09
Rot. Bonds3

About 2-(hydrazinecarbonyl)-3-phenyl-1H-indole-5-sulfonamide

2-(hydrazinecarbonyl)-3-phenyl-1H-indole-5-sulfonamide (PubChem CID 14611919) has the molecular formula C15H14N4O3S and a molecular weight of 330.37 g/mol. Its IUPAC name is 2-(hydrazinecarbonyl)-3-phenyl-1H-indole-5-sulfonamide.

Molecular Properties

Compound Name2-(hydrazinecarbonyl)-3-phenyl-1H-indole-5-sulfonamide
PubChem CID14611919
Molecular FormulaC15H14N4O3S
Molecular Weight330.37 g/mol
Exact Mass330.08
IUPAC Name2-(hydrazinecarbonyl)-3-phenyl-1H-indole-5-sulfonamide
SMILESNNC(=O)c1[nH]c2ccc(S(N)(=O)=O)cc2c1-c1ccccc1
InChIInChI=1S/C15H14N4O3S/c16-19-15(20)14-13(9-4-2-1-3-5-9)11-8-10(23(17,21)22)6-7-12(11)18-14/h1-8,18H,16H2,(H,19,20)(H2,17,21,22)
InChIKeyPPDLAUCFAOODER-UHFFFAOYSA-N
XLogP1.09
TPSA131.07 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.37
LogP ≤ 51.09
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'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 2-(hydrazinecarbonyl)-3-phenyl-1H-indole-5-sulfonamide?
The IUPAC name of 2-(hydrazinecarbonyl)-3-phenyl-1H-indole-5-sulfonamide (CID 14611919) is 2-(hydrazinecarbonyl)-3-phenyl-1H-indole-5-sulfonamide.
What is the SMILES notation for 2-(hydrazinecarbonyl)-3-phenyl-1H-indole-5-sulfonamide?
The canonical SMILES for 2-(hydrazinecarbonyl)-3-phenyl-1H-indole-5-sulfonamide is NNC(=O)c1[nH]c2ccc(S(N)(=O)=O)cc2c1-c1ccccc1.
What is the InChIKey of 2-(hydrazinecarbonyl)-3-phenyl-1H-indole-5-sulfonamide?
The InChIKey is PPDLAUCFAOODER-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O3S/c16-19-15(20)14-13(9-4-2-1-3-5-9)11-8-10(23(17,21)22)6-7-12(11)18-14/h1-8,18H,16H2,(H,19,20)(H2,17,21,22).
What are the key properties of 2-(hydrazinecarbonyl)-3-phenyl-1H-indole-5-sulfonamide?
2-(hydrazinecarbonyl)-3-phenyl-1H-indole-5-sulfonamide has a molecular weight of 330.37 g/mol, XLogP of 1.09, 3 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(hydrazinecarbonyl)-3-phenyl-1H-indole-5-sulfonamide is sourced from PubChem (CID 14611919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).