[(4-methylsulfonylphenyl)-phenylmethyl]hydrazine

C14H16N2O2S — CID 105282883

IUPAC[(4-methylsulfonylphenyl)-phenylmethyl]hydrazine
SMILESCS(=O)(=O)c1ccc(C(NN)c2ccccc2)cc1
InChIInChI=1S/C14H16N2O2S/c1-19(17,18)13-9-7-12(8-10-13)14(16-15)11-5-3-2-4-6-11/h2-10,14,16H,15H2,1H3
InChIKeyAISCKKQDZSFTAK-UHFFFAOYSA-N
MW276.36 g/mol
LogP1.64
Rot. Bonds4

About [(4-methylsulfonylphenyl)-phenylmethyl]hydrazine

[(4-methylsulfonylphenyl)-phenylmethyl]hydrazine (PubChem CID 105282883) has the molecular formula C14H16N2O2S and a molecular weight of 276.36 g/mol. Its IUPAC name is [(4-methylsulfonylphenyl)-phenylmethyl]hydrazine.

Molecular Properties

Compound Name[(4-methylsulfonylphenyl)-phenylmethyl]hydrazine
PubChem CID105282883
Molecular FormulaC14H16N2O2S
Molecular Weight276.36 g/mol
Exact Mass276.09
IUPAC Name[(4-methylsulfonylphenyl)-phenylmethyl]hydrazine
SMILESCS(=O)(=O)c1ccc(C(NN)c2ccccc2)cc1
InChIInChI=1S/C14H16N2O2S/c1-19(17,18)13-9-7-12(8-10-13)14(16-15)11-5-3-2-4-6-11/h2-10,14,16H,15H2,1H3
InChIKeyAISCKKQDZSFTAK-UHFFFAOYSA-N
XLogP1.64
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.36
LogP ≤ 51.64
H-Bond Donors ≤ 52
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-[(4-methylsulfonylphenyl)-phenylmethyl]ethanamine
CID 43489121
[1-(4-methylsulfonylphenyl)-2-phenylethyl]hydrazine
CID 105283057
2-(4-methylsulfonylphenyl)-2-phenylethanol
CID 67638441
bis(1-phenylethylhydrazine);sulfate
CID 20976345
(2R)-2-amino-N-(4-methylsulfonylphenyl)-2-phenylacetamide
CID 61148899
N-[(R)-(3,4-dimethylphenyl)-phenylmethyl]-4-methylsulfonylbenzamide
CID 26177688
1-[bromo-(4-methylsulfonylphenyl)methyl]-4-phenylbenzene
CID 22767119
1-(benzenesulfonyl)-4-methylsulfonylbenzene
CID 13498252
1-(4-methylsulfonylphenyl)-2-(1-phenylethylamino)ethanol
CID 110896898
amino-(4-methylsulfonylphenyl)methanol
CID 116939660
[3-ethyl-1-(4-methylsulfonylphenyl)pentyl]hydrazine
CID 105330976
N-methyl-2-(4-methylsulfonylphenyl)-1-phenylethanamine
CID 63199908

Frequently Asked Questions

What is the IUPAC name of [(4-methylsulfonylphenyl)-phenylmethyl]hydrazine?
The IUPAC name of [(4-methylsulfonylphenyl)-phenylmethyl]hydrazine (CID 105282883) is [(4-methylsulfonylphenyl)-phenylmethyl]hydrazine.
What is the SMILES notation for [(4-methylsulfonylphenyl)-phenylmethyl]hydrazine?
The canonical SMILES for [(4-methylsulfonylphenyl)-phenylmethyl]hydrazine is CS(=O)(=O)c1ccc(C(NN)c2ccccc2)cc1.
What is the InChIKey of [(4-methylsulfonylphenyl)-phenylmethyl]hydrazine?
The InChIKey is AISCKKQDZSFTAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2S/c1-19(17,18)13-9-7-12(8-10-13)14(16-15)11-5-3-2-4-6-11/h2-10,14,16H,15H2,1H3.
What are the key properties of [(4-methylsulfonylphenyl)-phenylmethyl]hydrazine?
[(4-methylsulfonylphenyl)-phenylmethyl]hydrazine has a molecular weight of 276.36 g/mol, XLogP of 1.64, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-methylsulfonylphenyl)-phenylmethyl]hydrazine is sourced from PubChem (CID 105282883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).