2-methyl-5-morpholin-4-yl-1,3-thiazole-4-carbohydrazide

C9H14N4O2S — CID 161101698

IUPAC2-methyl-5-morpholin-4-yl-1,3-thiazole-4-carbohydrazide
SMILESCc1nc(C(=O)NN)c(N2CCOCC2)s1
InChIInChI=1S/C9H14N4O2S/c1-6-11-7(8(14)12-10)9(16-6)13-2-4-15-5-3-13/h2-5,10H2,1H3,(H,12,14)
InChIKeyUINBOBBTHQAWMH-UHFFFAOYSA-N
MW242.30 g/mol
LogP-0.11
Rot. Bonds2

About 2-methyl-5-morpholin-4-yl-1,3-thiazole-4-carbohydrazide

2-methyl-5-morpholin-4-yl-1,3-thiazole-4-carbohydrazide (PubChem CID 161101698) has the molecular formula C9H14N4O2S and a molecular weight of 242.30 g/mol. Its IUPAC name is 2-methyl-5-morpholin-4-yl-1,3-thiazole-4-carbohydrazide.

Molecular Properties

Compound Name2-methyl-5-morpholin-4-yl-1,3-thiazole-4-carbohydrazide
PubChem CID161101698
Molecular FormulaC9H14N4O2S
Molecular Weight242.30 g/mol
Exact Mass242.08
IUPAC Name2-methyl-5-morpholin-4-yl-1,3-thiazole-4-carbohydrazide
SMILESCc1nc(C(=O)NN)c(N2CCOCC2)s1
InChIInChI=1S/C9H14N4O2S/c1-6-11-7(8(14)12-10)9(16-6)13-2-4-15-5-3-13/h2-5,10H2,1H3,(H,12,14)
InChIKeyUINBOBBTHQAWMH-UHFFFAOYSA-N
XLogP-0.11
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.30
LogP ≤ 5-0.11
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

5-(3-Oxomorpholin-4-yl)-2-(trifluoromethyl)-1,3-thiazole-4-carbohydrazide
CID 126482666
tert-butyl N-[[5-(3-oxomorpholin-4-yl)-2-(trifluoromethyl)-1,3-thiazole-4-carbonyl]amino]carbamate
CID 134461702
5-Morpholin-4-yl-2-(trifluoromethyl)-1,3-thiazole-4-carbohydrazide
CID 137355678
Ethane;5-(3-oxomorpholin-4-yl)-2-(trifluoromethyl)-1,3-thiazole-4-carbohydrazide
CID 142553274
5-[Methyl-[2-(2-oxoethoxy)ethyl]amino]-2-(trifluoromethyl)-1,3-thiazole-4-carbohydrazide
CID 167159314
N'-tert-butyl-N'-ethyl-2-(1-fluorocyclobutyl)-5-morpholin-4-yl-1,3-thiazole-4-carbohydrazide
CID 172695787
5-[Ethyl(methyl)amino]-2-(trifluoromethyl)-1,3-thiazole-4-carbohydrazide
CID 154040324
5-Amino-2-(methylthio)-N-4-morpholinyl-4-thiazolecarboxamide
CID 124153884
2-(1-Ethoxycyclobutyl)-5-morpholinothiazole-4-carbohydrazide
CID 126482426
tert-butyl N-[[5-morpholin-4-yl-2-(2-morpholin-4-ylpropan-2-yl)-1,3-thiazole-4-carbonyl]amino]carbamate
CID 126482675
tert-butyl N-ethyl-N-[[5-morpholin-4-yl-2-(2-morpholin-4-ylpropan-2-yl)-1,3-thiazole-4-carbonyl]amino]carbamate
CID 126482835
ethyl N-tert-butyl-N-[[5-morpholin-4-yl-2-(2-morpholin-4-ylpropan-2-yl)-1,3-thiazole-4-carbonyl]amino]carbamate
CID 126482836

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-morpholin-4-yl-1,3-thiazole-4-carbohydrazide?
The IUPAC name of 2-methyl-5-morpholin-4-yl-1,3-thiazole-4-carbohydrazide (CID 161101698) is 2-methyl-5-morpholin-4-yl-1,3-thiazole-4-carbohydrazide.
What is the SMILES notation for 2-methyl-5-morpholin-4-yl-1,3-thiazole-4-carbohydrazide?
The canonical SMILES for 2-methyl-5-morpholin-4-yl-1,3-thiazole-4-carbohydrazide is Cc1nc(C(=O)NN)c(N2CCOCC2)s1.
What is the InChIKey of 2-methyl-5-morpholin-4-yl-1,3-thiazole-4-carbohydrazide?
The InChIKey is UINBOBBTHQAWMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O2S/c1-6-11-7(8(14)12-10)9(16-6)13-2-4-15-5-3-13/h2-5,10H2,1H3,(H,12,14).
What are the key properties of 2-methyl-5-morpholin-4-yl-1,3-thiazole-4-carbohydrazide?
2-methyl-5-morpholin-4-yl-1,3-thiazole-4-carbohydrazide has a molecular weight of 242.30 g/mol, XLogP of -0.11, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-morpholin-4-yl-1,3-thiazole-4-carbohydrazide is sourced from PubChem (CID 161101698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).