[1,3-dimethyl-4-(2-methylpropylsulfanylmethyl)pyrazol-5-yl]hydrazine

C10H20N4S — CID 62252125

IUPAC[1,3-dimethyl-4-(2-methylpropylsulfanylmethyl)pyrazol-5-yl]hydrazine
SMILESCc1nn(C)c(NN)c1CSCC(C)C
InChIInChI=1S/C10H20N4S/c1-7(2)5-15-6-9-8(3)13-14(4)10(9)12-11/h7,12H,5-6,11H2,1-4H3
InChIKeyFAYWMKPXUPTSTN-UHFFFAOYSA-N
MW228.36 g/mol
LogP1.90
Rot. Bonds5

About [1,3-dimethyl-4-(2-methylpropylsulfanylmethyl)pyrazol-5-yl]hydrazine

[1,3-dimethyl-4-(2-methylpropylsulfanylmethyl)pyrazol-5-yl]hydrazine (PubChem CID 62252125) has the molecular formula C10H20N4S and a molecular weight of 228.36 g/mol. Its IUPAC name is [1,3-dimethyl-4-(2-methylpropylsulfanylmethyl)pyrazol-5-yl]hydrazine.

Molecular Properties

Compound Name[1,3-dimethyl-4-(2-methylpropylsulfanylmethyl)pyrazol-5-yl]hydrazine
PubChem CID62252125
Molecular FormulaC10H20N4S
Molecular Weight228.36 g/mol
Exact Mass228.14
IUPAC Name[1,3-dimethyl-4-(2-methylpropylsulfanylmethyl)pyrazol-5-yl]hydrazine
SMILESCc1nn(C)c(NN)c1CSCC(C)C
InChIInChI=1S/C10H20N4S/c1-7(2)5-15-6-9-8(3)13-14(4)10(9)12-11/h7,12H,5-6,11H2,1-4H3
InChIKeyFAYWMKPXUPTSTN-UHFFFAOYSA-N
XLogP1.90
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.36
LogP ≤ 51.90
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

N-[(5-hydrazinyl-1,3-dimethylpyrazol-4-yl)methyl]-N,3-dimethylbutan-1-amine
CID 62245540
[4-(methoxymethyl)-1,3-dimethylpyrazol-5-yl]hydrazine
CID 62245433
N-[(5-hydrazinyl-1,3-dimethylpyrazol-4-yl)methyl]-N,3-dimethylbutan-2-amine
CID 62245689
N-[(5-hydrazinyl-1,3-dimethylpyrazol-4-yl)methyl]-N,2-dimethylbutan-1-amine
CID 62246707
N,1,3-trimethyl-4-(methylsulfanylmethyl)pyrazol-5-amine
CID 62189145
[4-(2-ethoxyethoxymethyl)-1,3-dimethylpyrazol-5-yl]hydrazine
CID 62246595
4-(tert-butylsulfanylmethyl)-1,3-dimethyl-N-propylpyrazol-5-amine
CID 55045129
[1,3-dimethyl-4-[(3-methylmorpholin-4-yl)methyl]pyrazol-5-yl]hydrazine
CID 62246236
[1,3-dimethyl-4-[(2-methylpiperidin-1-yl)methyl]pyrazol-5-yl]hydrazine
CID 62244988
[1,3-dimethyl-4-[(3-methylphenoxy)methyl]pyrazol-5-yl]hydrazine
CID 62244686
N-ethyl-1,3-dimethyl-4-(propan-2-yloxymethyl)pyrazol-5-amine
CID 62194625
N,1,3-trimethyl-4-(pyrimidin-2-ylsulfanylmethyl)pyrazol-5-amine
CID 62189467

Frequently Asked Questions

What is the IUPAC name of [1,3-dimethyl-4-(2-methylpropylsulfanylmethyl)pyrazol-5-yl]hydrazine?
The IUPAC name of [1,3-dimethyl-4-(2-methylpropylsulfanylmethyl)pyrazol-5-yl]hydrazine (CID 62252125) is [1,3-dimethyl-4-(2-methylpropylsulfanylmethyl)pyrazol-5-yl]hydrazine.
What is the SMILES notation for [1,3-dimethyl-4-(2-methylpropylsulfanylmethyl)pyrazol-5-yl]hydrazine?
The canonical SMILES for [1,3-dimethyl-4-(2-methylpropylsulfanylmethyl)pyrazol-5-yl]hydrazine is Cc1nn(C)c(NN)c1CSCC(C)C.
What is the InChIKey of [1,3-dimethyl-4-(2-methylpropylsulfanylmethyl)pyrazol-5-yl]hydrazine?
The InChIKey is FAYWMKPXUPTSTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N4S/c1-7(2)5-15-6-9-8(3)13-14(4)10(9)12-11/h7,12H,5-6,11H2,1-4H3.
What are the key properties of [1,3-dimethyl-4-(2-methylpropylsulfanylmethyl)pyrazol-5-yl]hydrazine?
[1,3-dimethyl-4-(2-methylpropylsulfanylmethyl)pyrazol-5-yl]hydrazine has a molecular weight of 228.36 g/mol, XLogP of 1.90, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1,3-dimethyl-4-(2-methylpropylsulfanylmethyl)pyrazol-5-yl]hydrazine is sourced from PubChem (CID 62252125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).