N-[4-(hydrazinecarbonyl)phenyl]pentane-1-sulfonamide

C12H19N3O3S — CID 67849300

IUPACN-[4-(hydrazinecarbonyl)phenyl]pentane-1-sulfonamide
SMILESCCCCCS(=O)(=O)Nc1ccc(C(=O)NN)cc1
InChIInChI=1S/C12H19N3O3S/c1-2-3-4-9-19(17,18)15-11-7-5-10(6-8-11)12(16)14-13/h5-8,15H,2-4,9,13H2,1H3,(H,14,16)
InChIKeyCRVDFZIEYLCLPV-UHFFFAOYSA-N
MW285.37 g/mol
LogP1.22
Rot. Bonds7

About N-[4-(hydrazinecarbonyl)phenyl]pentane-1-sulfonamide

N-[4-(hydrazinecarbonyl)phenyl]pentane-1-sulfonamide (PubChem CID 67849300) has the molecular formula C12H19N3O3S and a molecular weight of 285.37 g/mol. Its IUPAC name is N-[4-(hydrazinecarbonyl)phenyl]pentane-1-sulfonamide.

Molecular Properties

Compound NameN-[4-(hydrazinecarbonyl)phenyl]pentane-1-sulfonamide
PubChem CID67849300
Molecular FormulaC12H19N3O3S
Molecular Weight285.37 g/mol
Exact Mass285.11
IUPAC NameN-[4-(hydrazinecarbonyl)phenyl]pentane-1-sulfonamide
SMILESCCCCCS(=O)(=O)Nc1ccc(C(=O)NN)cc1
InChIInChI=1S/C12H19N3O3S/c1-2-3-4-9-19(17,18)15-11-7-5-10(6-8-11)12(16)14-13/h5-8,15H,2-4,9,13H2,1H3,(H,14,16)
InChIKeyCRVDFZIEYLCLPV-UHFFFAOYSA-N
XLogP1.22
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.37
LogP ≤ 51.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

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benzohydrazide;pentane-1-sulfonamide
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Frequently Asked Questions

What is the IUPAC name of N-[4-(hydrazinecarbonyl)phenyl]pentane-1-sulfonamide?
The IUPAC name of N-[4-(hydrazinecarbonyl)phenyl]pentane-1-sulfonamide (CID 67849300) is N-[4-(hydrazinecarbonyl)phenyl]pentane-1-sulfonamide.
What is the SMILES notation for N-[4-(hydrazinecarbonyl)phenyl]pentane-1-sulfonamide?
The canonical SMILES for N-[4-(hydrazinecarbonyl)phenyl]pentane-1-sulfonamide is CCCCCS(=O)(=O)Nc1ccc(C(=O)NN)cc1.
What is the InChIKey of N-[4-(hydrazinecarbonyl)phenyl]pentane-1-sulfonamide?
The InChIKey is CRVDFZIEYLCLPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O3S/c1-2-3-4-9-19(17,18)15-11-7-5-10(6-8-11)12(16)14-13/h5-8,15H,2-4,9,13H2,1H3,(H,14,16).
What are the key properties of N-[4-(hydrazinecarbonyl)phenyl]pentane-1-sulfonamide?
N-[4-(hydrazinecarbonyl)phenyl]pentane-1-sulfonamide has a molecular weight of 285.37 g/mol, XLogP of 1.22, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(hydrazinecarbonyl)phenyl]pentane-1-sulfonamide is sourced from PubChem (CID 67849300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).