N-[2-(dimethylsulfamoyl)ethyl]-3-hydrazinylpyridine-4-carboxamide

C10H17N5O3S — CID 106340949

IUPACN-[2-(dimethylsulfamoyl)ethyl]-3-hydrazinylpyridine-4-carboxamide
SMILESCN(C)S(=O)(=O)CCNC(=O)c1ccncc1NN
InChIInChI=1S/C10H17N5O3S/c1-15(2)19(17,18)6-5-13-10(16)8-3-4-12-7-9(8)14-11/h3-4,7,14H,5-6,11H2,1-2H3,(H,13,16)
InChIKeyHATKRJBLFRJDPM-UHFFFAOYSA-N
MW287.34 g/mol
LogP-1.01
Rot. Bonds6

About N-[2-(dimethylsulfamoyl)ethyl]-3-hydrazinylpyridine-4-carboxamide

N-[2-(dimethylsulfamoyl)ethyl]-3-hydrazinylpyridine-4-carboxamide (PubChem CID 106340949) has the molecular formula C10H17N5O3S and a molecular weight of 287.34 g/mol. Its IUPAC name is N-[2-(dimethylsulfamoyl)ethyl]-3-hydrazinylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylsulfamoyl)ethyl]-3-hydrazinylpyridine-4-carboxamide
PubChem CID106340949
Molecular FormulaC10H17N5O3S
Molecular Weight287.34 g/mol
Exact Mass287.11
IUPAC NameN-[2-(dimethylsulfamoyl)ethyl]-3-hydrazinylpyridine-4-carboxamide
SMILESCN(C)S(=O)(=O)CCNC(=O)c1ccncc1NN
InChIInChI=1S/C10H17N5O3S/c1-15(2)19(17,18)6-5-13-10(16)8-3-4-12-7-9(8)14-11/h3-4,7,14H,5-6,11H2,1-2H3,(H,13,16)
InChIKeyHATKRJBLFRJDPM-UHFFFAOYSA-N
XLogP-1.01
TPSA117.42 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.34
LogP ≤ 5-1.01
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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Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylsulfamoyl)ethyl]-3-hydrazinylpyridine-4-carboxamide?
The IUPAC name of N-[2-(dimethylsulfamoyl)ethyl]-3-hydrazinylpyridine-4-carboxamide (CID 106340949) is N-[2-(dimethylsulfamoyl)ethyl]-3-hydrazinylpyridine-4-carboxamide.
What is the SMILES notation for N-[2-(dimethylsulfamoyl)ethyl]-3-hydrazinylpyridine-4-carboxamide?
The canonical SMILES for N-[2-(dimethylsulfamoyl)ethyl]-3-hydrazinylpyridine-4-carboxamide is CN(C)S(=O)(=O)CCNC(=O)c1ccncc1NN.
What is the InChIKey of N-[2-(dimethylsulfamoyl)ethyl]-3-hydrazinylpyridine-4-carboxamide?
The InChIKey is HATKRJBLFRJDPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5O3S/c1-15(2)19(17,18)6-5-13-10(16)8-3-4-12-7-9(8)14-11/h3-4,7,14H,5-6,11H2,1-2H3,(H,13,16).
What are the key properties of N-[2-(dimethylsulfamoyl)ethyl]-3-hydrazinylpyridine-4-carboxamide?
N-[2-(dimethylsulfamoyl)ethyl]-3-hydrazinylpyridine-4-carboxamide has a molecular weight of 287.34 g/mol, XLogP of -1.01, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylsulfamoyl)ethyl]-3-hydrazinylpyridine-4-carboxamide is sourced from PubChem (CID 106340949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).