2-hydrazinyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzenesulfonamide

C14H23N3O2S — CID 79350502

IUPAC2-hydrazinyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzenesulfonamide
SMILESCC1(C)C(CNS(=O)(=O)c2ccccc2NN)C1(C)C
InChIInChI=1S/C14H23N3O2S/c1-13(2)12(14(13,3)4)9-16-20(18,19)11-8-6-5-7-10(11)17-15/h5-8,12,16-17H,9,15H2,1-4H3
InChIKeyKKOOQCVZFRKAMT-UHFFFAOYSA-N
MW297.42 g/mol
LogP1.93
Rot. Bonds5

About 2-hydrazinyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzenesulfonamide

2-hydrazinyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzenesulfonamide (PubChem CID 79350502) has the molecular formula C14H23N3O2S and a molecular weight of 297.42 g/mol. Its IUPAC name is 2-hydrazinyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzenesulfonamide.

Molecular Properties

Compound Name2-hydrazinyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzenesulfonamide
PubChem CID79350502
Molecular FormulaC14H23N3O2S
Molecular Weight297.42 g/mol
Exact Mass297.15
IUPAC Name2-hydrazinyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzenesulfonamide
SMILESCC1(C)C(CNS(=O)(=O)c2ccccc2NN)C1(C)C
InChIInChI=1S/C14H23N3O2S/c1-13(2)12(14(13,3)4)9-16-20(18,19)11-8-6-5-7-10(11)17-15/h5-8,12,16-17H,9,15H2,1-4H3
InChIKeyKKOOQCVZFRKAMT-UHFFFAOYSA-N
XLogP1.93
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.42
LogP ≤ 51.93
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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

N-ethyl-2-hydrazinylbenzenesulfonamide
CID 43454365
N-butyl-2-hydrazinylbenzenesulfonamide
CID 43454845
N-(cyclohexylmethyl)-2-hydrazinylbenzenesulfonamide
CID 43455192
N-benzyl-2-hydrazinylbenzenesulfonamide
CID 43454886
2-hydrazinyl-N-(5-methylhexyl)benzenesulfonamide
CID 113287642
2-(methylamino)-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyridine-3-sulfonamide
CID 79356890
2-hydrazinyl-N-(4,4,4-trifluorobutyl)benzenesulfonamide
CID 113327826
2-hydrazinyl-N-[(2-methoxyphenyl)methyl]benzenesulfonamide
CID 43454817
5-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]-1H-pyrazole-4-sulfonamide
CID 79350868
5-(aminomethyl)-2-chloro-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzenesulfonamide
CID 79361372
4-bromo-2-fluoro-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzenesulfonamide
CID 116528715
2-hydrazinyl-N-(thiophen-3-ylmethyl)benzenesulfonamide
CID 63244355

Frequently Asked Questions

What is the IUPAC name of 2-hydrazinyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzenesulfonamide?
The IUPAC name of 2-hydrazinyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzenesulfonamide (CID 79350502) is 2-hydrazinyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzenesulfonamide.
What is the SMILES notation for 2-hydrazinyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzenesulfonamide?
The canonical SMILES for 2-hydrazinyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzenesulfonamide is CC1(C)C(CNS(=O)(=O)c2ccccc2NN)C1(C)C.
What is the InChIKey of 2-hydrazinyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzenesulfonamide?
The InChIKey is KKOOQCVZFRKAMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2S/c1-13(2)12(14(13,3)4)9-16-20(18,19)11-8-6-5-7-10(11)17-15/h5-8,12,16-17H,9,15H2,1-4H3.
What are the key properties of 2-hydrazinyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzenesulfonamide?
2-hydrazinyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzenesulfonamide has a molecular weight of 297.42 g/mol, XLogP of 1.93, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzenesulfonamide is sourced from PubChem (CID 79350502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).