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

C10H16N4O2S — CID 63568492

IUPAC4-[(2-methylmorpholin-4-yl)methyl]-1,3-thiazole-2-carbohydrazide
SMILESCC1CN(Cc2csc(C(=O)NN)n2)CCO1
InChIInChI=1S/C10H16N4O2S/c1-7-4-14(2-3-16-7)5-8-6-17-10(12-8)9(15)13-11/h6-7H,2-5,11H2,1H3,(H,13,15)
InChIKeyFJNCRDHDMXELCL-UHFFFAOYSA-N
MW256.33 g/mol
LogP-0.03
Rot. Bonds3

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

4-[(2-methylmorpholin-4-yl)methyl]-1,3-thiazole-2-carbohydrazide (PubChem CID 63568492) has the molecular formula C10H16N4O2S and a molecular weight of 256.33 g/mol. Its IUPAC name is 4-[(2-methylmorpholin-4-yl)methyl]-1,3-thiazole-2-carbohydrazide.

Molecular Properties

Compound Name4-[(2-methylmorpholin-4-yl)methyl]-1,3-thiazole-2-carbohydrazide
PubChem CID63568492
Molecular FormulaC10H16N4O2S
Molecular Weight256.33 g/mol
Exact Mass256.10
IUPAC Name4-[(2-methylmorpholin-4-yl)methyl]-1,3-thiazole-2-carbohydrazide
SMILESCC1CN(Cc2csc(C(=O)NN)n2)CCO1
InChIInChI=1S/C10H16N4O2S/c1-7-4-14(2-3-16-7)5-8-6-17-10(12-8)9(15)13-11/h6-7H,2-5,11H2,1H3,(H,13,15)
InChIKeyFJNCRDHDMXELCL-UHFFFAOYSA-N
XLogP-0.03
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.33
LogP ≤ 5-0.03
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

N-[4-[(2-methylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]acetamide
CID 51294676
4-[(2,2,6-trimethylmorpholin-4-yl)methyl]-1,3-thiazole-2-carbohydrazide
CID 55212685
N-[[4-[(2-methylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]methyl]ethanamine
CID 55070265
(2S)-2-methyl-4-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]morpholine
CID 94381346
1-[[2-(hydrazinecarbonyl)-1,3-thiazol-4-yl]methyl]-N-methylpiperidine-3-carboxamide
CID 103198388
4-[(4-hydroxy-4-methylpiperidin-1-yl)methyl]-1,3-thiazole-2-carbohydrazide
CID 81116115
4-[(4-cyclopropylpiperazin-1-yl)methyl]-1,3-thiazole-2-carbohydrazide
CID 55212106
4-[[4-(hydroxymethyl)piperidin-1-yl]methyl]-1,3-thiazole-2-carbohydrazide
CID 55212834
4-[(4,4-diethylpiperidin-1-yl)methyl]-1,3-thiazole-2-carbohydrazide
CID 63583716
4-[[4-(methoxymethyl)piperidin-1-yl]methyl]-1,3-thiazole-2-carbohydrazide
CID 63979914
2-methyl-4-[(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl]morpholine
CID 134055306
4-[[2-(hydrazinecarbonyl)-1,3-thiazol-4-yl]methyl]-N-methylmorpholine-3-carboxamide
CID 83105768

Frequently Asked Questions

What is the IUPAC name of 4-[(2-methylmorpholin-4-yl)methyl]-1,3-thiazole-2-carbohydrazide?
The IUPAC name of 4-[(2-methylmorpholin-4-yl)methyl]-1,3-thiazole-2-carbohydrazide (CID 63568492) is 4-[(2-methylmorpholin-4-yl)methyl]-1,3-thiazole-2-carbohydrazide.
What is the SMILES notation for 4-[(2-methylmorpholin-4-yl)methyl]-1,3-thiazole-2-carbohydrazide?
The canonical SMILES for 4-[(2-methylmorpholin-4-yl)methyl]-1,3-thiazole-2-carbohydrazide is CC1CN(Cc2csc(C(=O)NN)n2)CCO1.
What is the InChIKey of 4-[(2-methylmorpholin-4-yl)methyl]-1,3-thiazole-2-carbohydrazide?
The InChIKey is FJNCRDHDMXELCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O2S/c1-7-4-14(2-3-16-7)5-8-6-17-10(12-8)9(15)13-11/h6-7H,2-5,11H2,1H3,(H,13,15).
What are the key properties of 4-[(2-methylmorpholin-4-yl)methyl]-1,3-thiazole-2-carbohydrazide?
4-[(2-methylmorpholin-4-yl)methyl]-1,3-thiazole-2-carbohydrazide has a molecular weight of 256.33 g/mol, XLogP of -0.03, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-methylmorpholin-4-yl)methyl]-1,3-thiazole-2-carbohydrazide is sourced from PubChem (CID 63568492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).