4-[(2,2,6-trimethylmorpholin-4-yl)methyl]-1,3-thiazole-2-carbohydrazide

C12H20N4O2S — CID 55212685

IUPAC4-[(2,2,6-trimethylmorpholin-4-yl)methyl]-1,3-thiazole-2-carbohydrazide
SMILESCC1CN(Cc2csc(C(=O)NN)n2)CC(C)(C)O1
InChIInChI=1S/C12H20N4O2S/c1-8-4-16(7-12(2,3)18-8)5-9-6-19-11(14-9)10(17)15-13/h6,8H,4-5,7,13H2,1-3H3,(H,15,17)
InChIKeyDQXZOHMADMLXRX-UHFFFAOYSA-N
MW284.38 g/mol
LogP0.75
Rot. Bonds3

About 4-[(2,2,6-trimethylmorpholin-4-yl)methyl]-1,3-thiazole-2-carbohydrazide

4-[(2,2,6-trimethylmorpholin-4-yl)methyl]-1,3-thiazole-2-carbohydrazide (PubChem CID 55212685) has the molecular formula C12H20N4O2S and a molecular weight of 284.38 g/mol. Its IUPAC name is 4-[(2,2,6-trimethylmorpholin-4-yl)methyl]-1,3-thiazole-2-carbohydrazide.

Molecular Properties

Compound Name4-[(2,2,6-trimethylmorpholin-4-yl)methyl]-1,3-thiazole-2-carbohydrazide
PubChem CID55212685
Molecular FormulaC12H20N4O2S
Molecular Weight284.38 g/mol
Exact Mass284.13
IUPAC Name4-[(2,2,6-trimethylmorpholin-4-yl)methyl]-1,3-thiazole-2-carbohydrazide
SMILESCC1CN(Cc2csc(C(=O)NN)n2)CC(C)(C)O1
InChIInChI=1S/C12H20N4O2S/c1-8-4-16(7-12(2,3)18-8)5-9-6-19-11(14-9)10(17)15-13/h6,8H,4-5,7,13H2,1-3H3,(H,15,17)
InChIKeyDQXZOHMADMLXRX-UHFFFAOYSA-N
XLogP0.75
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.38
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-[(2-methylmorpholin-4-yl)methyl]-1,3-thiazole-2-carbohydrazide
CID 63568492
4-[(4-hydroxy-4-methylpiperidin-1-yl)methyl]-1,3-thiazole-2-carbohydrazide
CID 81116115
5-methyl-4-[(2,2,6-trimethylmorpholin-4-yl)methyl]furan-2-carbohydrazide
CID 63583647
4-[(4-cyclopropylpiperazin-1-yl)methyl]-1,3-thiazole-2-carbohydrazide
CID 55212106
4-[(4,4-diethylpiperidin-1-yl)methyl]-1,3-thiazole-2-carbohydrazide
CID 63583716
2-[(2,2,6-trimethylmorpholin-4-yl)methyl]furan-3-carbohydrazide
CID 63583097
4-[[4-(hydroxymethyl)piperidin-1-yl]methyl]-1,3-thiazole-2-carbohydrazide
CID 55212834
4-[(6,6-dimethyl-2,4-dioxo-3-azabicyclo[3.1.0]hexan-3-yl)methyl]-1,3-thiazole-2-carbohydrazide
CID 64829448
4-[[4-(methoxymethyl)piperidin-1-yl]methyl]-1,3-thiazole-2-carbohydrazide
CID 63979914
1-[[2-(hydrazinecarbonyl)-1,3-thiazol-4-yl]methyl]-N-methylpiperidine-3-carboxamide
CID 103198388
6-[(2,2,6-trimethylmorpholin-4-yl)methyl]pyridin-2-amine
CID 79243466
4-[(2,5-dioxopyrrolidin-1-yl)methyl]-1,3-thiazole-2-carbohydrazide
CID 63572048

Frequently Asked Questions

What is the IUPAC name of 4-[(2,2,6-trimethylmorpholin-4-yl)methyl]-1,3-thiazole-2-carbohydrazide?
The IUPAC name of 4-[(2,2,6-trimethylmorpholin-4-yl)methyl]-1,3-thiazole-2-carbohydrazide (CID 55212685) is 4-[(2,2,6-trimethylmorpholin-4-yl)methyl]-1,3-thiazole-2-carbohydrazide.
What is the SMILES notation for 4-[(2,2,6-trimethylmorpholin-4-yl)methyl]-1,3-thiazole-2-carbohydrazide?
The canonical SMILES for 4-[(2,2,6-trimethylmorpholin-4-yl)methyl]-1,3-thiazole-2-carbohydrazide is CC1CN(Cc2csc(C(=O)NN)n2)CC(C)(C)O1.
What is the InChIKey of 4-[(2,2,6-trimethylmorpholin-4-yl)methyl]-1,3-thiazole-2-carbohydrazide?
The InChIKey is DQXZOHMADMLXRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O2S/c1-8-4-16(7-12(2,3)18-8)5-9-6-19-11(14-9)10(17)15-13/h6,8H,4-5,7,13H2,1-3H3,(H,15,17).
What are the key properties of 4-[(2,2,6-trimethylmorpholin-4-yl)methyl]-1,3-thiazole-2-carbohydrazide?
4-[(2,2,6-trimethylmorpholin-4-yl)methyl]-1,3-thiazole-2-carbohydrazide has a molecular weight of 284.38 g/mol, XLogP of 0.75, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2,2,6-trimethylmorpholin-4-yl)methyl]-1,3-thiazole-2-carbohydrazide is sourced from PubChem (CID 55212685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).