N-(2-cyclohexyloxyethyl)-6-hydrazinylpyridine-3-sulfonamide

C13H22N4O3S — CID 63829030

IUPACN-(2-cyclohexyloxyethyl)-6-hydrazinylpyridine-3-sulfonamide
SMILESNNc1ccc(S(=O)(=O)NCCOC2CCCCC2)cn1
InChIInChI=1S/C13H22N4O3S/c14-17-13-7-6-12(10-15-13)21(18,19)16-8-9-20-11-4-2-1-3-5-11/h6-7,10-11,16H,1-5,8-9,14H2,(H,15,17)
InChIKeyVBVPHCASKGBOET-UHFFFAOYSA-N
MW314.41 g/mol
LogP0.99
Rot. Bonds7

About N-(2-cyclohexyloxyethyl)-6-hydrazinylpyridine-3-sulfonamide

N-(2-cyclohexyloxyethyl)-6-hydrazinylpyridine-3-sulfonamide (PubChem CID 63829030) has the molecular formula C13H22N4O3S and a molecular weight of 314.41 g/mol. Its IUPAC name is N-(2-cyclohexyloxyethyl)-6-hydrazinylpyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(2-cyclohexyloxyethyl)-6-hydrazinylpyridine-3-sulfonamide
PubChem CID63829030
Molecular FormulaC13H22N4O3S
Molecular Weight314.41 g/mol
Exact Mass314.14
IUPAC NameN-(2-cyclohexyloxyethyl)-6-hydrazinylpyridine-3-sulfonamide
SMILESNNc1ccc(S(=O)(=O)NCCOC2CCCCC2)cn1
InChIInChI=1S/C13H22N4O3S/c14-17-13-7-6-12(10-15-13)21(18,19)16-8-9-20-11-4-2-1-3-5-11/h6-7,10-11,16H,1-5,8-9,14H2,(H,15,17)
InChIKeyVBVPHCASKGBOET-UHFFFAOYSA-N
XLogP0.99
TPSA106.34 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.41
LogP ≤ 50.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'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

2-amino-N-(2-cyclopentyloxyethyl)pyrimidine-5-sulfonamide
CID 55260708
4-bromo-N-(2-cyclohexyloxyethyl)benzenesulfonamide
CID 61061043
N-(2-cyclopentyloxyethyl)benzenesulfonamide
CID 61060137
N-(2-cycloheptyloxyethyl)-5-pyrrolidin-1-ylsulfonylpyridin-2-amine
CID 133308701
3-amino-N-(2-cyclopentyloxyethyl)-4-methylbenzenesulfonamide
CID 63824236
3-amino-N-(2-cyclohexyloxyethyl)pyridine-2-sulfonamide
CID 103306082
6-hydrazinyl-N-[(4-methylcyclohexyl)methyl]pyridine-3-sulfonamide
CID 63244170
6-hydrazinyl-N-(4-methylpentyl)pyridine-3-sulfonamide
CID 63003893
N-(1-cyclohexylethyl)-6-hydrazinylpyridine-3-sulfonamide
CID 62405456
3-(aminomethyl)-N-(2-cyclopentyloxyethyl)-4-fluorobenzenesulfonamide
CID 63827191
6-hydrazinyl-N-(4-propan-2-yloxybutyl)pyridine-3-sulfonamide
CID 106012409
[5-(cyclopentylsulfonimidoyl)-2-pyridinyl]hydrazine
CID 166754651

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexyloxyethyl)-6-hydrazinylpyridine-3-sulfonamide?
The IUPAC name of N-(2-cyclohexyloxyethyl)-6-hydrazinylpyridine-3-sulfonamide (CID 63829030) is N-(2-cyclohexyloxyethyl)-6-hydrazinylpyridine-3-sulfonamide.
What is the SMILES notation for N-(2-cyclohexyloxyethyl)-6-hydrazinylpyridine-3-sulfonamide?
The canonical SMILES for N-(2-cyclohexyloxyethyl)-6-hydrazinylpyridine-3-sulfonamide is NNc1ccc(S(=O)(=O)NCCOC2CCCCC2)cn1.
What is the InChIKey of N-(2-cyclohexyloxyethyl)-6-hydrazinylpyridine-3-sulfonamide?
The InChIKey is VBVPHCASKGBOET-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O3S/c14-17-13-7-6-12(10-15-13)21(18,19)16-8-9-20-11-4-2-1-3-5-11/h6-7,10-11,16H,1-5,8-9,14H2,(H,15,17).
What are the key properties of N-(2-cyclohexyloxyethyl)-6-hydrazinylpyridine-3-sulfonamide?
N-(2-cyclohexyloxyethyl)-6-hydrazinylpyridine-3-sulfonamide has a molecular weight of 314.41 g/mol, XLogP of 0.99, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexyloxyethyl)-6-hydrazinylpyridine-3-sulfonamide is sourced from PubChem (CID 63829030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).