[1-(4-methyl-3-pyridinyl)-4-methylsulfonylbutyl]hydrazine

C11H19N3O2S — CID 105279776

IUPAC[1-(4-methyl-3-pyridinyl)-4-methylsulfonylbutyl]hydrazine
SMILESCc1ccncc1C(CCCS(C)(=O)=O)NN
InChIInChI=1S/C11H19N3O2S/c1-9-5-6-13-8-10(9)11(14-12)4-3-7-17(2,15)16/h5-6,8,11,14H,3-4,7,12H2,1-2H3
InChIKeyLTTQIHDIARCWKH-UHFFFAOYSA-N
MW257.36 g/mol
LogP0.72
Rot. Bonds6

About [1-(4-methyl-3-pyridinyl)-4-methylsulfonylbutyl]hydrazine

[1-(4-methyl-3-pyridinyl)-4-methylsulfonylbutyl]hydrazine (PubChem CID 105279776) has the molecular formula C11H19N3O2S and a molecular weight of 257.36 g/mol. Its IUPAC name is [1-(4-methyl-3-pyridinyl)-4-methylsulfonylbutyl]hydrazine.

Molecular Properties

Compound Name[1-(4-methyl-3-pyridinyl)-4-methylsulfonylbutyl]hydrazine
PubChem CID105279776
Molecular FormulaC11H19N3O2S
Molecular Weight257.36 g/mol
Exact Mass257.12
IUPAC Name[1-(4-methyl-3-pyridinyl)-4-methylsulfonylbutyl]hydrazine
SMILESCc1ccncc1C(CCCS(C)(=O)=O)NN
InChIInChI=1S/C11H19N3O2S/c1-9-5-6-13-8-10(9)11(14-12)4-3-7-17(2,15)16/h5-6,8,11,14H,3-4,7,12H2,1-2H3
InChIKeyLTTQIHDIARCWKH-UHFFFAOYSA-N
XLogP0.72
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.36
LogP ≤ 50.72
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-methyl-1-(4-methyl-3-pyridinyl)hexyl]hydrazine
CID 105279962
1-(4-methyl-3-pyridinyl)nonylhydrazine
CID 105279792
[1-(2,4-dimethylphenyl)-4-methylsulfonylbutyl]hydrazine
CID 105290842
1-(4-methyl-3-pyridinyl)hex-5-enylhydrazine
CID 105279755
[1-(2-fluoro-3-methylphenyl)-4-methylsulfonylbutyl]hydrazine
CID 105290996
[1-(3,4-dimethylphenyl)-4-methylsulfonylbutyl]hydrazine
CID 105290819
[1-(4-methyl-3-pyridinyl)-3-pyridin-4-ylpropyl]hydrazine
CID 105320620
[3-methoxy-1-(4-methyl-3-pyridinyl)propyl]hydrazine
CID 105206412
[1-(6-methyl-3-pyridinyl)-4-methylsulfonylbutyl]hydrazine
CID 105290849
[4-methoxy-1-(4-methyl-3-pyridinyl)pentyl]hydrazine
CID 105320582
1-(3-methyl-4-pyridinyl)pentylhydrazine
CID 105261719
[1-(2,5-dimethylphenyl)-3-methylsulfonylpropyl]hydrazine
CID 114985081

Frequently Asked Questions

What is the IUPAC name of [1-(4-methyl-3-pyridinyl)-4-methylsulfonylbutyl]hydrazine?
The IUPAC name of [1-(4-methyl-3-pyridinyl)-4-methylsulfonylbutyl]hydrazine (CID 105279776) is [1-(4-methyl-3-pyridinyl)-4-methylsulfonylbutyl]hydrazine.
What is the SMILES notation for [1-(4-methyl-3-pyridinyl)-4-methylsulfonylbutyl]hydrazine?
The canonical SMILES for [1-(4-methyl-3-pyridinyl)-4-methylsulfonylbutyl]hydrazine is Cc1ccncc1C(CCCS(C)(=O)=O)NN.
What is the InChIKey of [1-(4-methyl-3-pyridinyl)-4-methylsulfonylbutyl]hydrazine?
The InChIKey is LTTQIHDIARCWKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2S/c1-9-5-6-13-8-10(9)11(14-12)4-3-7-17(2,15)16/h5-6,8,11,14H,3-4,7,12H2,1-2H3.
What are the key properties of [1-(4-methyl-3-pyridinyl)-4-methylsulfonylbutyl]hydrazine?
[1-(4-methyl-3-pyridinyl)-4-methylsulfonylbutyl]hydrazine has a molecular weight of 257.36 g/mol, XLogP of 0.72, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-methyl-3-pyridinyl)-4-methylsulfonylbutyl]hydrazine is sourced from PubChem (CID 105279776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).