N-ethyl-N-[(2S)-2-hydrazinyl-3,3-dimethylbutyl]pyridine-2-sulfonamide

C13H24N4O2S — CID 143141951

IUPACN-ethyl-N-[(2S)-2-hydrazinyl-3,3-dimethylbutyl]pyridine-2-sulfonamide
SMILESCCN(C[C@@H](NN)C(C)(C)C)S(=O)(=O)c1ccccn1
InChIInChI=1S/C13H24N4O2S/c1-5-17(10-11(16-14)13(2,3)4)20(18,19)12-8-6-7-9-15-12/h6-9,11,16H,5,10,14H2,1-4H3/t11-/m1/s1
InChIKeyUMJNYNZSVFENAL-LLVKDONJSA-N
MW300.43 g/mol
LogP0.97
Rot. Bonds6

About N-ethyl-N-[(2S)-2-hydrazinyl-3,3-dimethylbutyl]pyridine-2-sulfonamide

N-ethyl-N-[(2S)-2-hydrazinyl-3,3-dimethylbutyl]pyridine-2-sulfonamide (PubChem CID 143141951) has the molecular formula C13H24N4O2S and a molecular weight of 300.43 g/mol. Its IUPAC name is N-ethyl-N-[(2S)-2-hydrazinyl-3,3-dimethylbutyl]pyridine-2-sulfonamide.

Molecular Properties

Compound NameN-ethyl-N-[(2S)-2-hydrazinyl-3,3-dimethylbutyl]pyridine-2-sulfonamide
PubChem CID143141951
Molecular FormulaC13H24N4O2S
Molecular Weight300.43 g/mol
Exact Mass300.16
IUPAC NameN-ethyl-N-[(2S)-2-hydrazinyl-3,3-dimethylbutyl]pyridine-2-sulfonamide
SMILESCCN(C[C@@H](NN)C(C)(C)C)S(=O)(=O)c1ccccn1
InChIInChI=1S/C13H24N4O2S/c1-5-17(10-11(16-14)13(2,3)4)20(18,19)12-8-6-7-9-15-12/h6-9,11,16H,5,10,14H2,1-4H3/t11-/m1/s1
InChIKeyUMJNYNZSVFENAL-LLVKDONJSA-N
XLogP0.97
TPSA88.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.43
LogP ≤ 50.97
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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Related Compounds

5-Aminopyridine-2-sulfonamide
CID 22313850
4-(Methylhydrazino)-3-pyridinesulfonamide
CID 46704078
3-amino-N-methylpyridine-2-sulfonamide
CID 103303715
(3R*,4S*)-4-isopropyl-1-(3-pyridinylsulfonyl)-3-pyrrolidinamine
CID 72899555
N-((1-isopropylpiperidin-4-yl)methyl)pyridine-3-sulfonamide
CID 45558510
5-Aminopyridine-2-sulfonamide hydrochloride
CID 137965837
N-tert-Butylpyridine-3-sulfonamide
CID 13648986
N-Methyl-2-pyridinesulfonamide
CID 19361829
N-(1-amino-2,4-dimethylpentan-2-yl)pyridine-3-sulfonamide
CID 75496146
N-(2-amino-2-ethylbutyl)pyridine-3-sulfonamide
CID 84591326
N-[(2S)-1-piperidin-1-ylpropan-2-yl]pyridine-3-sulfonamide
CID 99827269
5-(Aminomethyl)pyridine-2-sulfonamide
CID 54857481

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[(2S)-2-hydrazinyl-3,3-dimethylbutyl]pyridine-2-sulfonamide?
The IUPAC name of N-ethyl-N-[(2S)-2-hydrazinyl-3,3-dimethylbutyl]pyridine-2-sulfonamide (CID 143141951) is N-ethyl-N-[(2S)-2-hydrazinyl-3,3-dimethylbutyl]pyridine-2-sulfonamide.
What is the SMILES notation for N-ethyl-N-[(2S)-2-hydrazinyl-3,3-dimethylbutyl]pyridine-2-sulfonamide?
The canonical SMILES for N-ethyl-N-[(2S)-2-hydrazinyl-3,3-dimethylbutyl]pyridine-2-sulfonamide is CCN(C[C@@H](NN)C(C)(C)C)S(=O)(=O)c1ccccn1.
What is the InChIKey of N-ethyl-N-[(2S)-2-hydrazinyl-3,3-dimethylbutyl]pyridine-2-sulfonamide?
The InChIKey is UMJNYNZSVFENAL-LLVKDONJSA-N. The full InChI is InChI=1S/C13H24N4O2S/c1-5-17(10-11(16-14)13(2,3)4)20(18,19)12-8-6-7-9-15-12/h6-9,11,16H,5,10,14H2,1-4H3/t11-/m1/s1.
What are the key properties of N-ethyl-N-[(2S)-2-hydrazinyl-3,3-dimethylbutyl]pyridine-2-sulfonamide?
N-ethyl-N-[(2S)-2-hydrazinyl-3,3-dimethylbutyl]pyridine-2-sulfonamide has a molecular weight of 300.43 g/mol, XLogP of 0.97, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[(2S)-2-hydrazinyl-3,3-dimethylbutyl]pyridine-2-sulfonamide is sourced from PubChem (CID 143141951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).