[2-(2-methylpropylsulfanyl)-1-(4-methyl-3-pyridinyl)ethyl]hydrazine

C12H21N3S — CID 105226844

IUPAC[2-(2-methylpropylsulfanyl)-1-(4-methyl-3-pyridinyl)ethyl]hydrazine
SMILESCc1ccncc1C(CSCC(C)C)NN
InChIInChI=1S/C12H21N3S/c1-9(2)7-16-8-12(15-13)11-6-14-5-4-10(11)3/h4-6,9,12,15H,7-8,13H2,1-3H3
InChIKeyULKFFSIHUDSZMS-UHFFFAOYSA-N
MW239.39 g/mol
LogP2.28
Rot. Bonds6

About [2-(2-methylpropylsulfanyl)-1-(4-methyl-3-pyridinyl)ethyl]hydrazine

[2-(2-methylpropylsulfanyl)-1-(4-methyl-3-pyridinyl)ethyl]hydrazine (PubChem CID 105226844) has the molecular formula C12H21N3S and a molecular weight of 239.39 g/mol. Its IUPAC name is [2-(2-methylpropylsulfanyl)-1-(4-methyl-3-pyridinyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(2-methylpropylsulfanyl)-1-(4-methyl-3-pyridinyl)ethyl]hydrazine
PubChem CID105226844
Molecular FormulaC12H21N3S
Molecular Weight239.39 g/mol
Exact Mass239.15
IUPAC Name[2-(2-methylpropylsulfanyl)-1-(4-methyl-3-pyridinyl)ethyl]hydrazine
SMILESCc1ccncc1C(CSCC(C)C)NN
InChIInChI=1S/C12H21N3S/c1-9(2)7-16-8-12(15-13)11-6-14-5-4-10(11)3/h4-6,9,12,15H,7-8,13H2,1-3H3
InChIKeyULKFFSIHUDSZMS-UHFFFAOYSA-N
XLogP2.28
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.39
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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
[2-(2-methylpropylsulfanyl)-1-pyrazin-2-ylethyl]hydrazine
CID 105226940
[4-methoxy-1-(4-methyl-3-pyridinyl)pentyl]hydrazine
CID 105320582
[1-(4-methyl-3-pyridinyl)-3-pyridin-4-ylpropyl]hydrazine
CID 105320620
[3-methoxy-1-(4-methyl-3-pyridinyl)propyl]hydrazine
CID 105206412
1-(4-methyl-3-pyridinyl)nonylhydrazine
CID 105279792
[2-(3,5-dimethylphenyl)-1-(4-methyl-3-pyridinyl)ethyl]hydrazine
CID 105212681
[1-(2-fluoro-5-methylphenyl)-2-(2-methylpropylsulfanyl)ethyl]hydrazine
CID 105226703
[2-(2-methylpropylsulfanyl)-1-quinolin-8-ylethyl]hydrazine
CID 105226697
1-(4-methyl-3-pyridinyl)hex-5-enylhydrazine
CID 105279755
4-methyl-1-(4-methyl-3-pyridinyl)pentan-1-ol
CID 66272896
N-ethyl-3-methyl-1-(4-methyl-3-pyridinyl)butan-1-amine
CID 66272697

Frequently Asked Questions

What is the IUPAC name of [2-(2-methylpropylsulfanyl)-1-(4-methyl-3-pyridinyl)ethyl]hydrazine?
The IUPAC name of [2-(2-methylpropylsulfanyl)-1-(4-methyl-3-pyridinyl)ethyl]hydrazine (CID 105226844) is [2-(2-methylpropylsulfanyl)-1-(4-methyl-3-pyridinyl)ethyl]hydrazine.
What is the SMILES notation for [2-(2-methylpropylsulfanyl)-1-(4-methyl-3-pyridinyl)ethyl]hydrazine?
The canonical SMILES for [2-(2-methylpropylsulfanyl)-1-(4-methyl-3-pyridinyl)ethyl]hydrazine is Cc1ccncc1C(CSCC(C)C)NN.
What is the InChIKey of [2-(2-methylpropylsulfanyl)-1-(4-methyl-3-pyridinyl)ethyl]hydrazine?
The InChIKey is ULKFFSIHUDSZMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3S/c1-9(2)7-16-8-12(15-13)11-6-14-5-4-10(11)3/h4-6,9,12,15H,7-8,13H2,1-3H3.
What are the key properties of [2-(2-methylpropylsulfanyl)-1-(4-methyl-3-pyridinyl)ethyl]hydrazine?
[2-(2-methylpropylsulfanyl)-1-(4-methyl-3-pyridinyl)ethyl]hydrazine has a molecular weight of 239.39 g/mol, XLogP of 2.28, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-methylpropylsulfanyl)-1-(4-methyl-3-pyridinyl)ethyl]hydrazine is sourced from PubChem (CID 105226844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).