[1-(2,5-dimethylpyrazol-3-yl)-3-propan-2-ylsulfanylpropan-2-yl]hydrazine

C11H22N4S — CID 105226150

IUPAC[1-(2,5-dimethylpyrazol-3-yl)-3-propan-2-ylsulfanylpropan-2-yl]hydrazine
SMILESCc1cc(CC(CSC(C)C)NN)n(C)n1
InChIInChI=1S/C11H22N4S/c1-8(2)16-7-10(13-12)6-11-5-9(3)14-15(11)4/h5,8,10,13H,6-7,12H2,1-4H3
InChIKeyBHLCMGVFAMJLQM-UHFFFAOYSA-N
MW242.39 g/mol
LogP1.24
Rot. Bonds6

About [1-(2,5-dimethylpyrazol-3-yl)-3-propan-2-ylsulfanylpropan-2-yl]hydrazine

[1-(2,5-dimethylpyrazol-3-yl)-3-propan-2-ylsulfanylpropan-2-yl]hydrazine (PubChem CID 105226150) has the molecular formula C11H22N4S and a molecular weight of 242.39 g/mol. Its IUPAC name is [1-(2,5-dimethylpyrazol-3-yl)-3-propan-2-ylsulfanylpropan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(2,5-dimethylpyrazol-3-yl)-3-propan-2-ylsulfanylpropan-2-yl]hydrazine
PubChem CID105226150
Molecular FormulaC11H22N4S
Molecular Weight242.39 g/mol
Exact Mass242.16
IUPAC Name[1-(2,5-dimethylpyrazol-3-yl)-3-propan-2-ylsulfanylpropan-2-yl]hydrazine
SMILESCc1cc(CC(CSC(C)C)NN)n(C)n1
InChIInChI=1S/C11H22N4S/c1-8(2)16-7-10(13-12)6-11-5-9(3)14-15(11)4/h5,8,10,13H,6-7,12H2,1-4H3
InChIKeyBHLCMGVFAMJLQM-UHFFFAOYSA-N
XLogP1.24
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.39
LogP ≤ 51.24
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-(2,5-dimethylpyrazol-3-yl)-3-propan-2-yloxypropan-2-yl]hydrazine
CID 105315707
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CID 105315889
4-(2,5-dimethylpyrazol-3-yl)-3-hydrazinyl-N,N-dimethylbutan-1-amine
CID 105259282
[1-(2,5-dimethylpyrazol-3-yl)-3-methoxy-4-methylpentan-2-yl]hydrazine
CID 105272137
[1-(2,5-dimethylpyrazol-3-yl)-5-methoxypentan-2-yl]hydrazine
CID 105225066
[1-(2,5-dimethylpyrazol-3-yl)-3-ethoxybutan-2-yl]hydrazine
CID 105222898
[1-(2,5-dimethylphenyl)-3-(2,5-dimethylpyrazol-3-yl)propan-2-yl]hydrazine
CID 105315883
[1-(2,5-dimethylpyrazol-3-yl)-4-(2-methylphenyl)butan-2-yl]hydrazine
CID 105315719
[1-(2,5-dimethylpyrazol-3-yl)-3-(1-methoxycyclobutyl)propan-2-yl]hydrazine
CID 103560494
1-(2,5-dimethylpyrazol-3-yl)-3,4-dimethylpentan-2-ol
CID 115811450
1-(2,5-dimethylpyrazol-3-yl)-N-methyl-3-(4-methylphenyl)sulfanylpropan-2-amine
CID 66064619
1-(2,5-dimethylpyrazol-3-yl)-N-methylundecan-2-amine
CID 104996240

Frequently Asked Questions

What is the IUPAC name of [1-(2,5-dimethylpyrazol-3-yl)-3-propan-2-ylsulfanylpropan-2-yl]hydrazine?
The IUPAC name of [1-(2,5-dimethylpyrazol-3-yl)-3-propan-2-ylsulfanylpropan-2-yl]hydrazine (CID 105226150) is [1-(2,5-dimethylpyrazol-3-yl)-3-propan-2-ylsulfanylpropan-2-yl]hydrazine.
What is the SMILES notation for [1-(2,5-dimethylpyrazol-3-yl)-3-propan-2-ylsulfanylpropan-2-yl]hydrazine?
The canonical SMILES for [1-(2,5-dimethylpyrazol-3-yl)-3-propan-2-ylsulfanylpropan-2-yl]hydrazine is Cc1cc(CC(CSC(C)C)NN)n(C)n1.
What is the InChIKey of [1-(2,5-dimethylpyrazol-3-yl)-3-propan-2-ylsulfanylpropan-2-yl]hydrazine?
The InChIKey is BHLCMGVFAMJLQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N4S/c1-8(2)16-7-10(13-12)6-11-5-9(3)14-15(11)4/h5,8,10,13H,6-7,12H2,1-4H3.
What are the key properties of [1-(2,5-dimethylpyrazol-3-yl)-3-propan-2-ylsulfanylpropan-2-yl]hydrazine?
[1-(2,5-dimethylpyrazol-3-yl)-3-propan-2-ylsulfanylpropan-2-yl]hydrazine has a molecular weight of 242.39 g/mol, XLogP of 1.24, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,5-dimethylpyrazol-3-yl)-3-propan-2-ylsulfanylpropan-2-yl]hydrazine is sourced from PubChem (CID 105226150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).