N-(cyclopropylmethyl)-4-hydrazinyl-N-methylbenzenesulfonamide

C11H17N3O2S — CID 60985675

IUPACN-(cyclopropylmethyl)-4-hydrazinyl-N-methylbenzenesulfonamide
SMILESCN(CC1CC1)S(=O)(=O)c1ccc(NN)cc1
InChIInChI=1S/C11H17N3O2S/c1-14(8-9-2-3-9)17(15,16)11-6-4-10(13-12)5-7-11/h4-7,9,13H,2-3,8,12H2,1H3
InChIKeyHGFMCLAJJXNTPN-UHFFFAOYSA-N
MW255.34 g/mol
LogP1.00
Rot. Bonds5

About N-(cyclopropylmethyl)-4-hydrazinyl-N-methylbenzenesulfonamide

N-(cyclopropylmethyl)-4-hydrazinyl-N-methylbenzenesulfonamide (PubChem CID 60985675) has the molecular formula C11H17N3O2S and a molecular weight of 255.34 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-4-hydrazinyl-N-methylbenzenesulfonamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-4-hydrazinyl-N-methylbenzenesulfonamide
PubChem CID60985675
Molecular FormulaC11H17N3O2S
Molecular Weight255.34 g/mol
Exact Mass255.10
IUPAC NameN-(cyclopropylmethyl)-4-hydrazinyl-N-methylbenzenesulfonamide
SMILESCN(CC1CC1)S(=O)(=O)c1ccc(NN)cc1
InChIInChI=1S/C11H17N3O2S/c1-14(8-9-2-3-9)17(15,16)11-6-4-10(13-12)5-7-11/h4-7,9,13H,2-3,8,12H2,1H3
InChIKeyHGFMCLAJJXNTPN-UHFFFAOYSA-N
XLogP1.00
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.34
LogP ≤ 51.00
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-(cyclopentylmethyl)-4-hydrazinyl-N-methylbenzenesulfonamide
CID 55248102
4-N-(cyclopropylmethyl)-4-N-methylbenzene-1,4-disulfonamide
CID 47291841
N-(cyclopropylmethyl)-N-ethyl-4-hydrazinylbenzenesulfonamide
CID 63955641
4-[cyclopropylmethyl(methyl)sulfamoyl]benzoic acid
CID 60952032
N-(cyclopropylmethyl)-N-methyl-4-[1-(methylamino)ethyl]benzenesulfonamide
CID 54884270
N-(cyclopropylmethyl)-4-ethoxy-N-methylbenzenesulfonamide
CID 95748590
4-hydrazinyl-N-methyl-N-(4-methylcyclohexyl)benzenesulfonamide
CID 61435229
4-(2-aminoethyl)-N-(cyclobutylmethyl)-N-methylbenzenesulfonamide
CID 62854746
4-methoxy-N-methyl-N-(oxan-4-ylmethyl)benzenesulfonamide
CID 110752470
4-(bromomethyl)-N-methyl-N-(oxan-4-ylmethyl)benzenesulfonamide
CID 65481628
N-(cyclohexylmethyl)-2-hydrazinyl-N-methylpyrimidine-5-sulfonamide
CID 61443170
4-bromo-N-(cyclopropylmethyl)-3-fluoro-N-methylbenzenesulfonamide
CID 103697406

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-4-hydrazinyl-N-methylbenzenesulfonamide?
The IUPAC name of N-(cyclopropylmethyl)-4-hydrazinyl-N-methylbenzenesulfonamide (CID 60985675) is N-(cyclopropylmethyl)-4-hydrazinyl-N-methylbenzenesulfonamide.
What is the SMILES notation for N-(cyclopropylmethyl)-4-hydrazinyl-N-methylbenzenesulfonamide?
The canonical SMILES for N-(cyclopropylmethyl)-4-hydrazinyl-N-methylbenzenesulfonamide is CN(CC1CC1)S(=O)(=O)c1ccc(NN)cc1.
What is the InChIKey of N-(cyclopropylmethyl)-4-hydrazinyl-N-methylbenzenesulfonamide?
The InChIKey is HGFMCLAJJXNTPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2S/c1-14(8-9-2-3-9)17(15,16)11-6-4-10(13-12)5-7-11/h4-7,9,13H,2-3,8,12H2,1H3.
What are the key properties of N-(cyclopropylmethyl)-4-hydrazinyl-N-methylbenzenesulfonamide?
N-(cyclopropylmethyl)-4-hydrazinyl-N-methylbenzenesulfonamide has a molecular weight of 255.34 g/mol, XLogP of 1.00, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-4-hydrazinyl-N-methylbenzenesulfonamide is sourced from PubChem (CID 60985675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).