[2-(4-chloro-1,3-diethylpyrazol-5-yl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine

C14H26ClN5S — CID 106446499

IUPAC[2-(4-chloro-1,3-diethylpyrazol-5-yl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine
SMILESCCc1nn(CC)c(CC(NN)C2CSCCN2C)c1Cl
InChIInChI=1S/C14H26ClN5S/c1-4-10-14(15)12(20(5-2)18-10)8-11(17-16)13-9-21-7-6-19(13)3/h11,13,17H,4-9,16H2,1-3H3
InChIKeyAGZQUGVIFRZRFT-UHFFFAOYSA-N
MW331.92 g/mol
LogP1.54
Rot. Bonds6

About [2-(4-chloro-1,3-diethylpyrazol-5-yl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine

[2-(4-chloro-1,3-diethylpyrazol-5-yl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine (PubChem CID 106446499) has the molecular formula C14H26ClN5S and a molecular weight of 331.92 g/mol. Its IUPAC name is [2-(4-chloro-1,3-diethylpyrazol-5-yl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(4-chloro-1,3-diethylpyrazol-5-yl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine
PubChem CID106446499
Molecular FormulaC14H26ClN5S
Molecular Weight331.92 g/mol
Exact Mass331.16
IUPAC Name[2-(4-chloro-1,3-diethylpyrazol-5-yl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine
SMILESCCc1nn(CC)c(CC(NN)C2CSCCN2C)c1Cl
InChIInChI=1S/C14H26ClN5S/c1-4-10-14(15)12(20(5-2)18-10)8-11(17-16)13-9-21-7-6-19(13)3/h11,13,17H,4-9,16H2,1-3H3
InChIKeyAGZQUGVIFRZRFT-UHFFFAOYSA-N
XLogP1.54
TPSA59.11 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.92
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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

[2-(4-chloro-1,3-diethylpyrazol-5-yl)-1-(2,2-dimethylcyclopropyl)ethyl]hydrazine
CID 107005746
2-(4-chloro-1-ethyl-3-methylpyrazol-5-yl)-1-(4-methylthiomorpholin-3-yl)ethanol
CID 103595562
[2-(4-ethylphenyl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine
CID 106446480
2-(4-chloro-1,3-diethylpyrazol-5-yl)-1-(thiolan-3-yl)ethanamine
CID 105161533
[2-(5-ethyl-2-pyridinyl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine
CID 106446379
[2-(2-chloro-5-fluorophenyl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine
CID 106446395
[1-(4-methylthiomorpholin-3-yl)-2-phenylethyl]hydrazine
CID 106446350
[2-(1-methylimidazol-2-yl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine
CID 106446326
[1-(4-chloro-1,3-diethylpyrazol-5-yl)-3-cyclopentylpropan-2-yl]hydrazine
CID 105318256
[2-(1-cyclopentylpyrazol-3-yl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine
CID 106446532
[1-(4-chloro-1,3-diethylpyrazol-5-yl)-3,3-dimethylpentan-2-yl]hydrazine
CID 105318284
2-(4-chloro-1,3-diethylpyrazol-5-yl)-N-ethyl-1-(thian-2-yl)ethanamine
CID 80627356

Frequently Asked Questions

What is the IUPAC name of [2-(4-chloro-1,3-diethylpyrazol-5-yl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine?
The IUPAC name of [2-(4-chloro-1,3-diethylpyrazol-5-yl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine (CID 106446499) is [2-(4-chloro-1,3-diethylpyrazol-5-yl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(4-chloro-1,3-diethylpyrazol-5-yl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine?
The canonical SMILES for [2-(4-chloro-1,3-diethylpyrazol-5-yl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine is CCc1nn(CC)c(CC(NN)C2CSCCN2C)c1Cl.
What is the InChIKey of [2-(4-chloro-1,3-diethylpyrazol-5-yl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine?
The InChIKey is AGZQUGVIFRZRFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26ClN5S/c1-4-10-14(15)12(20(5-2)18-10)8-11(17-16)13-9-21-7-6-19(13)3/h11,13,17H,4-9,16H2,1-3H3.
What are the key properties of [2-(4-chloro-1,3-diethylpyrazol-5-yl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine?
[2-(4-chloro-1,3-diethylpyrazol-5-yl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine has a molecular weight of 331.92 g/mol, XLogP of 1.54, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-chloro-1,3-diethylpyrazol-5-yl)-1-(4-methylthiomorpholin-3-yl)ethyl]hydrazine is sourced from PubChem (CID 106446499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).