N',N'-dimethyl-2-phenylpyridine-3-sulfonohydrazide

C13H15N3O2S — CID 70209387

IUPACN',N'-dimethyl-2-phenylpyridine-3-sulfonohydrazide
SMILESCN(C)NS(=O)(=O)c1cccnc1-c1ccccc1
InChIInChI=1S/C13H15N3O2S/c1-16(2)15-19(17,18)12-9-6-10-14-13(12)11-7-4-3-5-8-11/h3-10,15H,1-2H3
InChIKeyNNKWDUJKLNWMCF-UHFFFAOYSA-N
MW277.35 g/mol
LogP1.50
Rot. Bonds4

About N',N'-dimethyl-2-phenylpyridine-3-sulfonohydrazide

N',N'-dimethyl-2-phenylpyridine-3-sulfonohydrazide (PubChem CID 70209387) has the molecular formula C13H15N3O2S and a molecular weight of 277.35 g/mol. Its IUPAC name is N',N'-dimethyl-2-phenylpyridine-3-sulfonohydrazide.

Molecular Properties

Compound NameN',N'-dimethyl-2-phenylpyridine-3-sulfonohydrazide
PubChem CID70209387
Molecular FormulaC13H15N3O2S
Molecular Weight277.35 g/mol
Exact Mass277.09
IUPAC NameN',N'-dimethyl-2-phenylpyridine-3-sulfonohydrazide
SMILESCN(C)NS(=O)(=O)c1cccnc1-c1ccccc1
InChIInChI=1S/C13H15N3O2S/c1-16(2)15-19(17,18)12-9-6-10-14-13(12)11-7-4-3-5-8-11/h3-10,15H,1-2H3
InChIKeyNNKWDUJKLNWMCF-UHFFFAOYSA-N
XLogP1.50
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.35
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N',N'-dimethyl-2-phenylpyridine-3-sulfonohydrazide?
The IUPAC name of N',N'-dimethyl-2-phenylpyridine-3-sulfonohydrazide (CID 70209387) is N',N'-dimethyl-2-phenylpyridine-3-sulfonohydrazide.
What is the SMILES notation for N',N'-dimethyl-2-phenylpyridine-3-sulfonohydrazide?
The canonical SMILES for N',N'-dimethyl-2-phenylpyridine-3-sulfonohydrazide is CN(C)NS(=O)(=O)c1cccnc1-c1ccccc1.
What is the InChIKey of N',N'-dimethyl-2-phenylpyridine-3-sulfonohydrazide?
The InChIKey is NNKWDUJKLNWMCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2S/c1-16(2)15-19(17,18)12-9-6-10-14-13(12)11-7-4-3-5-8-11/h3-10,15H,1-2H3.
What are the key properties of N',N'-dimethyl-2-phenylpyridine-3-sulfonohydrazide?
N',N'-dimethyl-2-phenylpyridine-3-sulfonohydrazide has a molecular weight of 277.35 g/mol, XLogP of 1.50, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-dimethyl-2-phenylpyridine-3-sulfonohydrazide is sourced from PubChem (CID 70209387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).