N'-(5-piperidin-1-ylsulfonyl-2-pyridinyl)benzenesulfonohydrazide

C16H20N4O4S2 — CID 31580113

IUPACN'-(5-piperidin-1-ylsulfonyl-2-pyridinyl)benzenesulfonohydrazide
SMILESO=S(=O)(NNc1ccc(S(=O)(=O)N2CCCCC2)cn1)c1ccccc1
InChIInChI=1S/C16H20N4O4S2/c21-25(22,14-7-3-1-4-8-14)19-18-16-10-9-15(13-17-16)26(23,24)20-11-5-2-6-12-20/h1,3-4,7-10,13,19H,2,5-6,11-12H2,(H,17,18)
InChIKeyDFMQDYUMFLVRHJ-UHFFFAOYSA-N
MW396.49 g/mol
LogP1.56
Rot. Bonds6

About N'-(5-piperidin-1-ylsulfonyl-2-pyridinyl)benzenesulfonohydrazide

N'-(5-piperidin-1-ylsulfonyl-2-pyridinyl)benzenesulfonohydrazide (PubChem CID 31580113) has the molecular formula C16H20N4O4S2 and a molecular weight of 396.49 g/mol. Its IUPAC name is N'-(5-piperidin-1-ylsulfonyl-2-pyridinyl)benzenesulfonohydrazide.

Molecular Properties

Compound NameN'-(5-piperidin-1-ylsulfonyl-2-pyridinyl)benzenesulfonohydrazide
PubChem CID31580113
Molecular FormulaC16H20N4O4S2
Molecular Weight396.49 g/mol
Exact Mass396.09
IUPAC NameN'-(5-piperidin-1-ylsulfonyl-2-pyridinyl)benzenesulfonohydrazide
SMILESO=S(=O)(NNc1ccc(S(=O)(=O)N2CCCCC2)cn1)c1ccccc1
InChIInChI=1S/C16H20N4O4S2/c21-25(22,14-7-3-1-4-8-14)19-18-16-10-9-15(13-17-16)26(23,24)20-11-5-2-6-12-20/h1,3-4,7-10,13,19H,2,5-6,11-12H2,(H,17,18)
InChIKeyDFMQDYUMFLVRHJ-UHFFFAOYSA-N
XLogP1.56
TPSA108.47 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.49
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

4-methyl-N'-(5-piperidin-1-ylsulfonyl-2-pyridinyl)benzenesulfonohydrazide
CID 31580125
4-fluoro-N'-(5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)benzenesulfonohydrazide
CID 39338201
1-phenyl-2-(5-piperidin-1-ylsulfonyl-2-pyridinyl)hydrazine
CID 5267961
N-benzyl-5-pyrrolidin-1-ylsulfonylpyridin-2-amine
CID 5268156
N-propan-2-yl-5-pyrrolidin-1-ylsulfonylpyridin-2-amine
CID 5268153
N-cyclopent-3-en-1-yl-5-piperidin-1-ylsulfonylpyridin-2-amine
CID 133362074
5-piperidin-1-ylsulfonyl-N-prop-2-ynylpyridin-2-amine
CID 9251897
4-(azepan-1-ylsulfonyl)-N'-(benzenesulfonyl)benzohydrazide
CID 1428605
N-methyl-3-[[(5-piperidin-1-ylsulfonyl-2-pyridinyl)amino]methyl]benzenesulfonamide
CID 55680935
N-[(2R)-4-phenylbutan-2-yl]-5-pyrrolidin-1-ylsulfonylpyridin-2-amine
CID 2485199
5-piperidin-1-ylsulfonyl-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]pyridin-2-amine
CID 9024535
5-piperidin-1-ylsulfonyl-N-(2-pyrazol-1-ylethyl)pyridin-2-amine
CID 133280931

Frequently Asked Questions

What is the IUPAC name of N'-(5-piperidin-1-ylsulfonyl-2-pyridinyl)benzenesulfonohydrazide?
The IUPAC name of N'-(5-piperidin-1-ylsulfonyl-2-pyridinyl)benzenesulfonohydrazide (CID 31580113) is N'-(5-piperidin-1-ylsulfonyl-2-pyridinyl)benzenesulfonohydrazide.
What is the SMILES notation for N'-(5-piperidin-1-ylsulfonyl-2-pyridinyl)benzenesulfonohydrazide?
The canonical SMILES for N'-(5-piperidin-1-ylsulfonyl-2-pyridinyl)benzenesulfonohydrazide is O=S(=O)(NNc1ccc(S(=O)(=O)N2CCCCC2)cn1)c1ccccc1.
What is the InChIKey of N'-(5-piperidin-1-ylsulfonyl-2-pyridinyl)benzenesulfonohydrazide?
The InChIKey is DFMQDYUMFLVRHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O4S2/c21-25(22,14-7-3-1-4-8-14)19-18-16-10-9-15(13-17-16)26(23,24)20-11-5-2-6-12-20/h1,3-4,7-10,13,19H,2,5-6,11-12H2,(H,17,18).
What are the key properties of N'-(5-piperidin-1-ylsulfonyl-2-pyridinyl)benzenesulfonohydrazide?
N'-(5-piperidin-1-ylsulfonyl-2-pyridinyl)benzenesulfonohydrazide has a molecular weight of 396.49 g/mol, XLogP of 1.56, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(5-piperidin-1-ylsulfonyl-2-pyridinyl)benzenesulfonohydrazide is sourced from PubChem (CID 31580113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).