[3-methyl-3-morpholin-4-yl-1-(1,3-thiazol-2-yl)butan-2-yl]hydrazine

C12H22N4OS — CID 105240194

IUPAC[3-methyl-3-morpholin-4-yl-1-(1,3-thiazol-2-yl)butan-2-yl]hydrazine
SMILESCC(C)(C(Cc1nccs1)NN)N1CCOCC1
InChIInChI=1S/C12H22N4OS/c1-12(2,16-4-6-17-7-5-16)10(15-13)9-11-14-3-8-18-11/h3,8,10,15H,4-7,9,13H2,1-2H3
InChIKeyARLMKRLHOJDADE-UHFFFAOYSA-N
MW270.40 g/mol
LogP0.63
Rot. Bonds5

About [3-methyl-3-morpholin-4-yl-1-(1,3-thiazol-2-yl)butan-2-yl]hydrazine

[3-methyl-3-morpholin-4-yl-1-(1,3-thiazol-2-yl)butan-2-yl]hydrazine (PubChem CID 105240194) has the molecular formula C12H22N4OS and a molecular weight of 270.40 g/mol. Its IUPAC name is [3-methyl-3-morpholin-4-yl-1-(1,3-thiazol-2-yl)butan-2-yl]hydrazine.

Molecular Properties

Compound Name[3-methyl-3-morpholin-4-yl-1-(1,3-thiazol-2-yl)butan-2-yl]hydrazine
PubChem CID105240194
Molecular FormulaC12H22N4OS
Molecular Weight270.40 g/mol
Exact Mass270.15
IUPAC Name[3-methyl-3-morpholin-4-yl-1-(1,3-thiazol-2-yl)butan-2-yl]hydrazine
SMILESCC(C)(C(Cc1nccs1)NN)N1CCOCC1
InChIInChI=1S/C12H22N4OS/c1-12(2,16-4-6-17-7-5-16)10(15-13)9-11-14-3-8-18-11/h3,8,10,15H,4-7,9,13H2,1-2H3
InChIKeyARLMKRLHOJDADE-UHFFFAOYSA-N
XLogP0.63
TPSA63.41 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.40
LogP ≤ 50.63
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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Frequently Asked Questions

What is the IUPAC name of [3-methyl-3-morpholin-4-yl-1-(1,3-thiazol-2-yl)butan-2-yl]hydrazine?
The IUPAC name of [3-methyl-3-morpholin-4-yl-1-(1,3-thiazol-2-yl)butan-2-yl]hydrazine (CID 105240194) is [3-methyl-3-morpholin-4-yl-1-(1,3-thiazol-2-yl)butan-2-yl]hydrazine.
What is the SMILES notation for [3-methyl-3-morpholin-4-yl-1-(1,3-thiazol-2-yl)butan-2-yl]hydrazine?
The canonical SMILES for [3-methyl-3-morpholin-4-yl-1-(1,3-thiazol-2-yl)butan-2-yl]hydrazine is CC(C)(C(Cc1nccs1)NN)N1CCOCC1.
What is the InChIKey of [3-methyl-3-morpholin-4-yl-1-(1,3-thiazol-2-yl)butan-2-yl]hydrazine?
The InChIKey is ARLMKRLHOJDADE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4OS/c1-12(2,16-4-6-17-7-5-16)10(15-13)9-11-14-3-8-18-11/h3,8,10,15H,4-7,9,13H2,1-2H3.
What are the key properties of [3-methyl-3-morpholin-4-yl-1-(1,3-thiazol-2-yl)butan-2-yl]hydrazine?
[3-methyl-3-morpholin-4-yl-1-(1,3-thiazol-2-yl)butan-2-yl]hydrazine has a molecular weight of 270.40 g/mol, XLogP of 0.63, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [3-methyl-3-morpholin-4-yl-1-(1,3-thiazol-2-yl)butan-2-yl]hydrazine is sourced from PubChem (CID 105240194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).