(6-methylsulfonyl-1-pyridin-2-ylhexan-3-yl)hydrazine

C12H21N3O2S — CID 105290925

IUPAC(6-methylsulfonyl-1-pyridin-2-ylhexan-3-yl)hydrazine
SMILESCS(=O)(=O)CCCC(CCc1ccccn1)NN
InChIInChI=1S/C12H21N3O2S/c1-18(16,17)10-4-6-12(15-13)8-7-11-5-2-3-9-14-11/h2-3,5,9,12,15H,4,6-8,10,13H2,1H3
InChIKeyGIXPSUDDGWPLGC-UHFFFAOYSA-N
MW271.39 g/mol
LogP0.67
Rot. Bonds8

About (6-methylsulfonyl-1-pyridin-2-ylhexan-3-yl)hydrazine

(6-methylsulfonyl-1-pyridin-2-ylhexan-3-yl)hydrazine (PubChem CID 105290925) has the molecular formula C12H21N3O2S and a molecular weight of 271.39 g/mol. Its IUPAC name is (6-methylsulfonyl-1-pyridin-2-ylhexan-3-yl)hydrazine.

Molecular Properties

Compound Name(6-methylsulfonyl-1-pyridin-2-ylhexan-3-yl)hydrazine
PubChem CID105290925
Molecular FormulaC12H21N3O2S
Molecular Weight271.39 g/mol
Exact Mass271.14
IUPAC Name(6-methylsulfonyl-1-pyridin-2-ylhexan-3-yl)hydrazine
SMILESCS(=O)(=O)CCCC(CCc1ccccn1)NN
InChIInChI=1S/C12H21N3O2S/c1-18(16,17)10-4-6-12(15-13)8-7-11-5-2-3-9-14-11/h2-3,5,9,12,15H,4,6-8,10,13H2,1H3
InChIKeyGIXPSUDDGWPLGC-UHFFFAOYSA-N
XLogP0.67
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.39
LogP ≤ 50.67
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

(6-methoxy-1-pyridin-2-ylhexan-3-yl)hydrazine
CID 105342539
1-pyridin-2-ylhept-6-yn-3-ylhydrazine
CID 105307905
(1-pyridin-2-yl-5-thiophen-3-ylpentan-3-yl)hydrazine
CID 105306797
(1-cyclopropyl-5-pyridin-2-ylpentan-3-yl)hydrazine
CID 105315136
(1-methylsulfonyl-7-thiophen-2-ylheptan-4-yl)hydrazine
CID 105290949
(5-methyl-1-pyridin-2-yloctan-3-yl)hydrazine
CID 105298189
(4-pyridin-2-yl-1-thiophen-2-ylbutan-2-yl)hydrazine
CID 105295527
(1-cyclobutyl-4-pyridin-2-ylbutan-2-yl)hydrazine
CID 105310094
[1-(2-methoxyphenyl)-5-methylsulfonylpentan-2-yl]hydrazine
CID 105204960
5-ethylsulfonyl-N-methyl-1-pyridin-2-ylpentan-2-amine
CID 65096002
[1-(1-methylpyrazol-3-yl)-4-pyridin-2-ylbutan-2-yl]hydrazine
CID 105329556
N-ethyl-1-pyridin-2-yloctan-3-amine
CID 105129891

Frequently Asked Questions

What is the IUPAC name of (6-methylsulfonyl-1-pyridin-2-ylhexan-3-yl)hydrazine?
The IUPAC name of (6-methylsulfonyl-1-pyridin-2-ylhexan-3-yl)hydrazine (CID 105290925) is (6-methylsulfonyl-1-pyridin-2-ylhexan-3-yl)hydrazine.
What is the SMILES notation for (6-methylsulfonyl-1-pyridin-2-ylhexan-3-yl)hydrazine?
The canonical SMILES for (6-methylsulfonyl-1-pyridin-2-ylhexan-3-yl)hydrazine is CS(=O)(=O)CCCC(CCc1ccccn1)NN.
What is the InChIKey of (6-methylsulfonyl-1-pyridin-2-ylhexan-3-yl)hydrazine?
The InChIKey is GIXPSUDDGWPLGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O2S/c1-18(16,17)10-4-6-12(15-13)8-7-11-5-2-3-9-14-11/h2-3,5,9,12,15H,4,6-8,10,13H2,1H3.
What are the key properties of (6-methylsulfonyl-1-pyridin-2-ylhexan-3-yl)hydrazine?
(6-methylsulfonyl-1-pyridin-2-ylhexan-3-yl)hydrazine has a molecular weight of 271.39 g/mol, XLogP of 0.67, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methylsulfonyl-1-pyridin-2-ylhexan-3-yl)hydrazine is sourced from PubChem (CID 105290925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).