N-(1-cyclopropylethyl)-2-hydrazinyl-N-methylpyridine-4-sulfonamide

C11H18N4O2S — CID 61003128

IUPACN-(1-cyclopropylethyl)-2-hydrazinyl-N-methylpyridine-4-sulfonamide
SMILESCC(C1CC1)N(C)S(=O)(=O)c1ccnc(NN)c1
InChIInChI=1S/C11H18N4O2S/c1-8(9-3-4-9)15(2)18(16,17)10-5-6-13-11(7-10)14-12/h5-9H,3-4,12H2,1-2H3,(H,13,14)
InChIKeyBZXOFULSLFEUSG-UHFFFAOYSA-N
MW270.36 g/mol
LogP0.79
Rot. Bonds5

About N-(1-cyclopropylethyl)-2-hydrazinyl-N-methylpyridine-4-sulfonamide

N-(1-cyclopropylethyl)-2-hydrazinyl-N-methylpyridine-4-sulfonamide (PubChem CID 61003128) has the molecular formula C11H18N4O2S and a molecular weight of 270.36 g/mol. Its IUPAC name is N-(1-cyclopropylethyl)-2-hydrazinyl-N-methylpyridine-4-sulfonamide.

Molecular Properties

Compound NameN-(1-cyclopropylethyl)-2-hydrazinyl-N-methylpyridine-4-sulfonamide
PubChem CID61003128
Molecular FormulaC11H18N4O2S
Molecular Weight270.36 g/mol
Exact Mass270.12
IUPAC NameN-(1-cyclopropylethyl)-2-hydrazinyl-N-methylpyridine-4-sulfonamide
SMILESCC(C1CC1)N(C)S(=O)(=O)c1ccnc(NN)c1
InChIInChI=1S/C11H18N4O2S/c1-8(9-3-4-9)15(2)18(16,17)10-5-6-13-11(7-10)14-12/h5-9H,3-4,12H2,1-2H3,(H,13,14)
InChIKeyBZXOFULSLFEUSG-UHFFFAOYSA-N
XLogP0.79
TPSA88.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.36
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylethyl)-2-hydrazinyl-N-methylpyridine-4-sulfonamide?
The IUPAC name of N-(1-cyclopropylethyl)-2-hydrazinyl-N-methylpyridine-4-sulfonamide (CID 61003128) is N-(1-cyclopropylethyl)-2-hydrazinyl-N-methylpyridine-4-sulfonamide.
What is the SMILES notation for N-(1-cyclopropylethyl)-2-hydrazinyl-N-methylpyridine-4-sulfonamide?
The canonical SMILES for N-(1-cyclopropylethyl)-2-hydrazinyl-N-methylpyridine-4-sulfonamide is CC(C1CC1)N(C)S(=O)(=O)c1ccnc(NN)c1.
What is the InChIKey of N-(1-cyclopropylethyl)-2-hydrazinyl-N-methylpyridine-4-sulfonamide?
The InChIKey is BZXOFULSLFEUSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O2S/c1-8(9-3-4-9)15(2)18(16,17)10-5-6-13-11(7-10)14-12/h5-9H,3-4,12H2,1-2H3,(H,13,14).
What are the key properties of N-(1-cyclopropylethyl)-2-hydrazinyl-N-methylpyridine-4-sulfonamide?
N-(1-cyclopropylethyl)-2-hydrazinyl-N-methylpyridine-4-sulfonamide has a molecular weight of 270.36 g/mol, XLogP of 0.79, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylethyl)-2-hydrazinyl-N-methylpyridine-4-sulfonamide is sourced from PubChem (CID 61003128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).