N-(2-morpholin-4-ylethyl)-2-phenyl-1,3-thiazole-4-carboxamide

C16H19N3O2S — CID 51253349

IUPACN-(2-morpholin-4-ylethyl)-2-phenyl-1,3-thiazole-4-carboxamide
SMILESO=C(NCCN1CCOCC1)c1csc(-c2ccccc2)n1
InChIInChI=1S/C16H19N3O2S/c20-15(17-6-7-19-8-10-21-11-9-19)14-12-22-16(18-14)13-4-2-1-3-5-13/h1-5,12H,6-11H2,(H,17,20)
InChIKeyFTCJVRXPNABLIS-UHFFFAOYSA-N
MW317.41 g/mol
LogP1.87
Rot. Bonds5

About N-(2-morpholin-4-ylethyl)-2-phenyl-1,3-thiazole-4-carboxamide

N-(2-morpholin-4-ylethyl)-2-phenyl-1,3-thiazole-4-carboxamide (PubChem CID 51253349) has the molecular formula C16H19N3O2S and a molecular weight of 317.41 g/mol. Its IUPAC name is N-(2-morpholin-4-ylethyl)-2-phenyl-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-(2-morpholin-4-ylethyl)-2-phenyl-1,3-thiazole-4-carboxamide
PubChem CID51253349
Molecular FormulaC16H19N3O2S
Molecular Weight317.41 g/mol
Exact Mass317.12
IUPAC NameN-(2-morpholin-4-ylethyl)-2-phenyl-1,3-thiazole-4-carboxamide
SMILESO=C(NCCN1CCOCC1)c1csc(-c2ccccc2)n1
InChIInChI=1S/C16H19N3O2S/c20-15(17-6-7-19-8-10-21-11-9-19)14-12-22-16(18-14)13-4-2-1-3-5-13/h1-5,12H,6-11H2,(H,17,20)
InChIKeyFTCJVRXPNABLIS-UHFFFAOYSA-N
XLogP1.87
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.41
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[4-[(2-chloro-6-fluorophenyl)methoxy]phenyl]-N-(2-morpholin-4-ylethyl)-1,3-thiazole-4-carboxamide
CID 42865863
N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)-2-phenyl-1,3-thiazole-4-carboxamide
CID 90607241
N-[2-(azepan-1-yl)ethyl]-2-(2-morpholin-4-yl-4-pyridinyl)-1,3-thiazole-4-carboxamide
CID 53119274
N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
CID 977791
N-(3-oxo-3-pyrrolidin-1-ylpropyl)-2-phenyl-1,3-thiazole-4-carboxamide
CID 18157145
6-bromo-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
CID 103875005
(2Z)-2-[4,4-difluoro-1-(2-phenyl-1,3-thiazole-4-carbonyl)-2,3-dihydro-1-benzazepin-5-ylidene]-N-(2-morpholin-4-ylethyl)acetamide
CID 15552385
2-[2-fluoro-4-[(3-fluorophenyl)methoxy]phenyl]-N-(2-morpholin-4-ylethyl)-1,3-thiazole-4-carboxamide
CID 42866233
N-(2-morpholin-4-ylethyl)-2-[[2-(trifluoromethyl)benzoyl]amino]-1,3-thiazole-4-carboxamide
CID 46114179
N-(2-morpholin-4-ylethyl)-3-phenyl-1,2-oxazole-4-carboxamide
CID 100772105
N-ethyl-2-phenyl-1,3-thiazole-4-carboxamide
CID 17398194
N-(2-piperazin-1-ylethyl)-2-(4-propan-2-ylphenyl)-1,3-thiazole-4-carboxamide
CID 119448939

Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-ylethyl)-2-phenyl-1,3-thiazole-4-carboxamide?
The IUPAC name of N-(2-morpholin-4-ylethyl)-2-phenyl-1,3-thiazole-4-carboxamide (CID 51253349) is N-(2-morpholin-4-ylethyl)-2-phenyl-1,3-thiazole-4-carboxamide.
What is the SMILES notation for N-(2-morpholin-4-ylethyl)-2-phenyl-1,3-thiazole-4-carboxamide?
The canonical SMILES for N-(2-morpholin-4-ylethyl)-2-phenyl-1,3-thiazole-4-carboxamide is O=C(NCCN1CCOCC1)c1csc(-c2ccccc2)n1.
What is the InChIKey of N-(2-morpholin-4-ylethyl)-2-phenyl-1,3-thiazole-4-carboxamide?
The InChIKey is FTCJVRXPNABLIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2S/c20-15(17-6-7-19-8-10-21-11-9-19)14-12-22-16(18-14)13-4-2-1-3-5-13/h1-5,12H,6-11H2,(H,17,20).
What are the key properties of N-(2-morpholin-4-ylethyl)-2-phenyl-1,3-thiazole-4-carboxamide?
N-(2-morpholin-4-ylethyl)-2-phenyl-1,3-thiazole-4-carboxamide has a molecular weight of 317.41 g/mol, XLogP of 1.87, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ylethyl)-2-phenyl-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 51253349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).