2-[(5-chloro-6-hydrazinyl-3-pyridinyl)sulfonylamino]propanamide

C8H12ClN5O3S — CID 64607030

IUPAC2-[(5-chloro-6-hydrazinyl-3-pyridinyl)sulfonylamino]propanamide
SMILESCC(NS(=O)(=O)c1cnc(NN)c(Cl)c1)C(N)=O
InChIInChI=1S/C8H12ClN5O3S/c1-4(7(10)15)14-18(16,17)5-2-6(9)8(13-11)12-3-5/h2-4,14H,11H2,1H3,(H2,10,15)(H,12,13)
InChIKeyLQEUBBCQDTUCAD-UHFFFAOYSA-N
MW293.74 g/mol
LogP-0.83
Rot. Bonds5

About 2-[(5-chloro-6-hydrazinyl-3-pyridinyl)sulfonylamino]propanamide

2-[(5-chloro-6-hydrazinyl-3-pyridinyl)sulfonylamino]propanamide (PubChem CID 64607030) has the molecular formula C8H12ClN5O3S and a molecular weight of 293.74 g/mol. Its IUPAC name is 2-[(5-chloro-6-hydrazinyl-3-pyridinyl)sulfonylamino]propanamide.

Molecular Properties

Compound Name2-[(5-chloro-6-hydrazinyl-3-pyridinyl)sulfonylamino]propanamide
PubChem CID64607030
Molecular FormulaC8H12ClN5O3S
Molecular Weight293.74 g/mol
Exact Mass293.03
IUPAC Name2-[(5-chloro-6-hydrazinyl-3-pyridinyl)sulfonylamino]propanamide
SMILESCC(NS(=O)(=O)c1cnc(NN)c(Cl)c1)C(N)=O
InChIInChI=1S/C8H12ClN5O3S/c1-4(7(10)15)14-18(16,17)5-2-6(9)8(13-11)12-3-5/h2-4,14H,11H2,1H3,(H2,10,15)(H,12,13)
InChIKeyLQEUBBCQDTUCAD-UHFFFAOYSA-N
XLogP-0.83
TPSA140.20 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.74
LogP ≤ 5-0.83
H-Bond Donors ≤ 54
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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Related Compounds

2-[[6-chloro-5-(trifluoromethyl)-3-pyridinyl]sulfonylamino]propanamide
CID 126822944
2-[[5-chloro-6-(ethylamino)-3-pyridinyl]sulfonylamino]-3-methylbutanamide
CID 106347072
5-chloro-6-hydrazinyl-N-(1-methoxypentan-2-yl)pyridine-3-sulfonamide
CID 64608202
5-chloro-6-hydrazinyl-N-propylpyridine-3-sulfonamide
CID 64607208
5-chloro-6-hydrazinyl-N-(3-methoxy-2-methylpropyl)pyridine-3-sulfonamide
CID 64608765
5-chloro-N-(2-chloro-4-methylphenyl)-6-hydrazinylpyridine-3-sulfonamide
CID 64608552
5-chloro-6-hydrazinyl-N-pyrimidin-2-ylpyridine-3-sulfonamide
CID 64608544
5-chloro-6-hydrazinyl-N-(1,2,4-triazin-3-yl)pyridine-3-sulfonamide
CID 114388272
5-chloro-6-hydrazinyl-N-(2-propan-2-ylpyrazol-3-yl)pyridine-3-sulfonamide
CID 64607395
2-[(5-bromo-3-chloro-2-pyridinyl)amino]propanamide
CID 103582387
2-[(2-chloro-4-methylphenyl)sulfonylamino]propanamide
CID 75841470
N-(4-bromophenyl)-5-chloro-6-hydrazinylpyridine-3-sulfonamide
CID 64607594

Frequently Asked Questions

What is the IUPAC name of 2-[(5-chloro-6-hydrazinyl-3-pyridinyl)sulfonylamino]propanamide?
The IUPAC name of 2-[(5-chloro-6-hydrazinyl-3-pyridinyl)sulfonylamino]propanamide (CID 64607030) is 2-[(5-chloro-6-hydrazinyl-3-pyridinyl)sulfonylamino]propanamide.
What is the SMILES notation for 2-[(5-chloro-6-hydrazinyl-3-pyridinyl)sulfonylamino]propanamide?
The canonical SMILES for 2-[(5-chloro-6-hydrazinyl-3-pyridinyl)sulfonylamino]propanamide is CC(NS(=O)(=O)c1cnc(NN)c(Cl)c1)C(N)=O.
What is the InChIKey of 2-[(5-chloro-6-hydrazinyl-3-pyridinyl)sulfonylamino]propanamide?
The InChIKey is LQEUBBCQDTUCAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12ClN5O3S/c1-4(7(10)15)14-18(16,17)5-2-6(9)8(13-11)12-3-5/h2-4,14H,11H2,1H3,(H2,10,15)(H,12,13).
What are the key properties of 2-[(5-chloro-6-hydrazinyl-3-pyridinyl)sulfonylamino]propanamide?
2-[(5-chloro-6-hydrazinyl-3-pyridinyl)sulfonylamino]propanamide has a molecular weight of 293.74 g/mol, XLogP of -0.83, 5 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-chloro-6-hydrazinyl-3-pyridinyl)sulfonylamino]propanamide is sourced from PubChem (CID 64607030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).