2-morpholin-4-yl-N'-(1-phenylcyclopropanecarbonyl)-1,3-thiazole-4-carbohydrazide

C18H20N4O3S — CID 32810379

IUPAC2-morpholin-4-yl-N'-(1-phenylcyclopropanecarbonyl)-1,3-thiazole-4-carbohydrazide
SMILESO=C(NNC(=O)C1(c2ccccc2)CC1)c1csc(N2CCOCC2)n1
InChIInChI=1S/C18H20N4O3S/c23-15(14-12-26-17(19-14)22-8-10-25-11-9-22)20-21-16(24)18(6-7-18)13-4-2-1-3-5-13/h1-5,12H,6-11H2,(H,20,23)(H,21,24)
InChIKeyJOZWGWZONKUATK-UHFFFAOYSA-N
MW372.45 g/mol
LogP1.47
Rot. Bonds4

About 2-morpholin-4-yl-N'-(1-phenylcyclopropanecarbonyl)-1,3-thiazole-4-carbohydrazide

2-morpholin-4-yl-N'-(1-phenylcyclopropanecarbonyl)-1,3-thiazole-4-carbohydrazide (PubChem CID 32810379) has the molecular formula C18H20N4O3S and a molecular weight of 372.45 g/mol. Its IUPAC name is 2-morpholin-4-yl-N'-(1-phenylcyclopropanecarbonyl)-1,3-thiazole-4-carbohydrazide.

Molecular Properties

Compound Name2-morpholin-4-yl-N'-(1-phenylcyclopropanecarbonyl)-1,3-thiazole-4-carbohydrazide
PubChem CID32810379
Molecular FormulaC18H20N4O3S
Molecular Weight372.45 g/mol
Exact Mass372.13
IUPAC Name2-morpholin-4-yl-N'-(1-phenylcyclopropanecarbonyl)-1,3-thiazole-4-carbohydrazide
SMILESO=C(NNC(=O)C1(c2ccccc2)CC1)c1csc(N2CCOCC2)n1
InChIInChI=1S/C18H20N4O3S/c23-15(14-12-26-17(19-14)22-8-10-25-11-9-22)20-21-16(24)18(6-7-18)13-4-2-1-3-5-13/h1-5,12H,6-11H2,(H,20,23)(H,21,24)
InChIKeyJOZWGWZONKUATK-UHFFFAOYSA-N
XLogP1.47
TPSA83.56 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.45
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-yl-N'-(1-phenylcyclopropanecarbonyl)-1,3-thiazole-4-carbohydrazide?
The IUPAC name of 2-morpholin-4-yl-N'-(1-phenylcyclopropanecarbonyl)-1,3-thiazole-4-carbohydrazide (CID 32810379) is 2-morpholin-4-yl-N'-(1-phenylcyclopropanecarbonyl)-1,3-thiazole-4-carbohydrazide.
What is the SMILES notation for 2-morpholin-4-yl-N'-(1-phenylcyclopropanecarbonyl)-1,3-thiazole-4-carbohydrazide?
The canonical SMILES for 2-morpholin-4-yl-N'-(1-phenylcyclopropanecarbonyl)-1,3-thiazole-4-carbohydrazide is O=C(NNC(=O)C1(c2ccccc2)CC1)c1csc(N2CCOCC2)n1.
What is the InChIKey of 2-morpholin-4-yl-N'-(1-phenylcyclopropanecarbonyl)-1,3-thiazole-4-carbohydrazide?
The InChIKey is JOZWGWZONKUATK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4O3S/c23-15(14-12-26-17(19-14)22-8-10-25-11-9-22)20-21-16(24)18(6-7-18)13-4-2-1-3-5-13/h1-5,12H,6-11H2,(H,20,23)(H,21,24).
What are the key properties of 2-morpholin-4-yl-N'-(1-phenylcyclopropanecarbonyl)-1,3-thiazole-4-carbohydrazide?
2-morpholin-4-yl-N'-(1-phenylcyclopropanecarbonyl)-1,3-thiazole-4-carbohydrazide has a molecular weight of 372.45 g/mol, XLogP of 1.47, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-yl-N'-(1-phenylcyclopropanecarbonyl)-1,3-thiazole-4-carbohydrazide is sourced from PubChem (CID 32810379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).