N-(4-morpholin-4-ylphenyl)-2-(4-phenyl-1,3-thiazol-5-yl)acetamide

C21H21N3O2S — CID 166351501

IUPACN-(4-morpholin-4-ylphenyl)-2-(4-phenyl-1,3-thiazol-5-yl)acetamide
SMILESO=C(Cc1scnc1-c1ccccc1)Nc1ccc(N2CCOCC2)cc1
InChIInChI=1S/C21H21N3O2S/c25-20(14-19-21(22-15-27-19)16-4-2-1-3-5-16)23-17-6-8-18(9-7-17)24-10-12-26-13-11-24/h1-9,15H,10-14H2,(H,23,25)
InChIKeyFWYZCBMPUMDILW-UHFFFAOYSA-N
MW379.49 g/mol
LogP3.83
Rot. Bonds5

About N-(4-morpholin-4-ylphenyl)-2-(4-phenyl-1,3-thiazol-5-yl)acetamide

N-(4-morpholin-4-ylphenyl)-2-(4-phenyl-1,3-thiazol-5-yl)acetamide (PubChem CID 166351501) has the molecular formula C21H21N3O2S and a molecular weight of 379.49 g/mol. Its IUPAC name is N-(4-morpholin-4-ylphenyl)-2-(4-phenyl-1,3-thiazol-5-yl)acetamide.

Molecular Properties

Compound NameN-(4-morpholin-4-ylphenyl)-2-(4-phenyl-1,3-thiazol-5-yl)acetamide
PubChem CID166351501
Molecular FormulaC21H21N3O2S
Molecular Weight379.49 g/mol
Exact Mass379.14
IUPAC NameN-(4-morpholin-4-ylphenyl)-2-(4-phenyl-1,3-thiazol-5-yl)acetamide
SMILESO=C(Cc1scnc1-c1ccccc1)Nc1ccc(N2CCOCC2)cc1
InChIInChI=1S/C21H21N3O2S/c25-20(14-19-21(22-15-27-19)16-4-2-1-3-5-16)23-17-6-8-18(9-7-17)24-10-12-26-13-11-24/h1-9,15H,10-14H2,(H,23,25)
InChIKeyFWYZCBMPUMDILW-UHFFFAOYSA-N
XLogP3.83
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.49
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

N-(4-morpholin-4-ylphenyl)-2-phenoxyacetamide
CID 675127
N-(4-morpholin-4-ylphenyl)-2-(6-oxo-4-phenylpyrimidin-1-yl)acetamide
CID 121063679
N-(4-morpholin-4-ylphenyl)-3-phenoxypropanamide
CID 26269482
(2-anilino-2-oxoethyl)-methyl-[2-(4-morpholin-4-ylanilino)-2-oxoethyl]azanium
CID 8592839
2-(2,6-dichlorophenyl)-N-(4-morpholin-4-ylphenyl)acetamide
CID 4276577
3-amino-N-(4-morpholin-4-ylphenyl)propanamide
CID 61252883
2-(1,2-benzoxazol-3-yl)-N-(4-morpholin-4-ylphenyl)acetamide
CID 35148080
methyl-[2-(4-morpholin-4-ylanilino)-2-oxoethyl]-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]azanium
CID 8592773
2-[4-methyl-5-[2-(4-morpholin-4-ylanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]-N-phenylacetamide
CID 3164715
N-(4-morpholin-4-ylphenyl)-3-phenylthiophene-2-carboxamide
CID 17444618
N-(4-morpholin-4-ylphenyl)-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetamide
CID 2124706
2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-N-(4-morpholin-4-ylphenyl)acetamide
CID 46559443

Frequently Asked Questions

What is the IUPAC name of N-(4-morpholin-4-ylphenyl)-2-(4-phenyl-1,3-thiazol-5-yl)acetamide?
The IUPAC name of N-(4-morpholin-4-ylphenyl)-2-(4-phenyl-1,3-thiazol-5-yl)acetamide (CID 166351501) is N-(4-morpholin-4-ylphenyl)-2-(4-phenyl-1,3-thiazol-5-yl)acetamide.
What is the SMILES notation for N-(4-morpholin-4-ylphenyl)-2-(4-phenyl-1,3-thiazol-5-yl)acetamide?
The canonical SMILES for N-(4-morpholin-4-ylphenyl)-2-(4-phenyl-1,3-thiazol-5-yl)acetamide is O=C(Cc1scnc1-c1ccccc1)Nc1ccc(N2CCOCC2)cc1.
What is the InChIKey of N-(4-morpholin-4-ylphenyl)-2-(4-phenyl-1,3-thiazol-5-yl)acetamide?
The InChIKey is FWYZCBMPUMDILW-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N3O2S/c25-20(14-19-21(22-15-27-19)16-4-2-1-3-5-16)23-17-6-8-18(9-7-17)24-10-12-26-13-11-24/h1-9,15H,10-14H2,(H,23,25).
What are the key properties of N-(4-morpholin-4-ylphenyl)-2-(4-phenyl-1,3-thiazol-5-yl)acetamide?
N-(4-morpholin-4-ylphenyl)-2-(4-phenyl-1,3-thiazol-5-yl)acetamide has a molecular weight of 379.49 g/mol, XLogP of 3.83, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-morpholin-4-ylphenyl)-2-(4-phenyl-1,3-thiazol-5-yl)acetamide is sourced from PubChem (CID 166351501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).