[1-propan-2-ylsulfanyl-3-(1-propylimidazol-2-yl)propan-2-yl]hydrazine

C12H24N4S — CID 105226247

IUPAC[1-propan-2-ylsulfanyl-3-(1-propylimidazol-2-yl)propan-2-yl]hydrazine
SMILESCCCn1ccnc1CC(CSC(C)C)NN
InChIInChI=1S/C12H24N4S/c1-4-6-16-7-5-14-12(16)8-11(15-13)9-17-10(2)3/h5,7,10-11,15H,4,6,8-9,13H2,1-3H3
InChIKeyDTIZFSLMNFFNBI-UHFFFAOYSA-N
MW256.42 g/mol
LogP1.81
Rot. Bonds8

About [1-propan-2-ylsulfanyl-3-(1-propylimidazol-2-yl)propan-2-yl]hydrazine

[1-propan-2-ylsulfanyl-3-(1-propylimidazol-2-yl)propan-2-yl]hydrazine (PubChem CID 105226247) has the molecular formula C12H24N4S and a molecular weight of 256.42 g/mol. Its IUPAC name is [1-propan-2-ylsulfanyl-3-(1-propylimidazol-2-yl)propan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-propan-2-ylsulfanyl-3-(1-propylimidazol-2-yl)propan-2-yl]hydrazine
PubChem CID105226247
Molecular FormulaC12H24N4S
Molecular Weight256.42 g/mol
Exact Mass256.17
IUPAC Name[1-propan-2-ylsulfanyl-3-(1-propylimidazol-2-yl)propan-2-yl]hydrazine
SMILESCCCn1ccnc1CC(CSC(C)C)NN
InChIInChI=1S/C12H24N4S/c1-4-6-16-7-5-14-12(16)8-11(15-13)9-17-10(2)3/h5,7,10-11,15H,4,6,8-9,13H2,1-3H3
InChIKeyDTIZFSLMNFFNBI-UHFFFAOYSA-N
XLogP1.81
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.42
LogP ≤ 51.81
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

[1-(1-ethylimidazol-2-yl)-3-propan-2-ylsulfanylpropan-2-yl]hydrazine
CID 105226285
N,4-dimethyl-1-(1-propylimidazol-2-yl)pentan-2-amine
CID 79752057
[3-ethyl-1-(1-propylimidazol-2-yl)pentan-2-yl]hydrazine
CID 105323296
[1-(1-propylimidazol-2-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-2-yl]hydrazine
CID 105323452
[4-(4-methylphenyl)-1-(1-propylimidazol-2-yl)butan-2-yl]hydrazine
CID 105323315
N-propyl-1-(1-propylimidazol-2-yl)heptan-2-amine
CID 105012472
2-methyl-3-(1-propylimidazol-2-yl)propanal
CID 64663884
5-methyl-1-(1-propylimidazol-2-yl)hexan-2-amine
CID 79751948
N,2,3-trimethyl-4-(1-propylimidazol-2-yl)butan-1-amine
CID 81016215
1,1-diethoxy-3-(1-propylimidazol-2-yl)propan-2-amine
CID 79760794
[1-(2-bicyclo[2.2.1]heptanyl)-3-(1-propylimidazol-2-yl)propan-2-yl]hydrazine
CID 105323310
[1-(2-chloro-6-fluorophenyl)-3-(1-propylimidazol-2-yl)propan-2-yl]hydrazine
CID 105216048

Frequently Asked Questions

What is the IUPAC name of [1-propan-2-ylsulfanyl-3-(1-propylimidazol-2-yl)propan-2-yl]hydrazine?
The IUPAC name of [1-propan-2-ylsulfanyl-3-(1-propylimidazol-2-yl)propan-2-yl]hydrazine (CID 105226247) is [1-propan-2-ylsulfanyl-3-(1-propylimidazol-2-yl)propan-2-yl]hydrazine.
What is the SMILES notation for [1-propan-2-ylsulfanyl-3-(1-propylimidazol-2-yl)propan-2-yl]hydrazine?
The canonical SMILES for [1-propan-2-ylsulfanyl-3-(1-propylimidazol-2-yl)propan-2-yl]hydrazine is CCCn1ccnc1CC(CSC(C)C)NN.
What is the InChIKey of [1-propan-2-ylsulfanyl-3-(1-propylimidazol-2-yl)propan-2-yl]hydrazine?
The InChIKey is DTIZFSLMNFFNBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N4S/c1-4-6-16-7-5-14-12(16)8-11(15-13)9-17-10(2)3/h5,7,10-11,15H,4,6,8-9,13H2,1-3H3.
What are the key properties of [1-propan-2-ylsulfanyl-3-(1-propylimidazol-2-yl)propan-2-yl]hydrazine?
[1-propan-2-ylsulfanyl-3-(1-propylimidazol-2-yl)propan-2-yl]hydrazine has a molecular weight of 256.42 g/mol, XLogP of 1.81, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-propan-2-ylsulfanyl-3-(1-propylimidazol-2-yl)propan-2-yl]hydrazine is sourced from PubChem (CID 105226247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).