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

C22H23N3O2S — CID 110426324

IUPACN-(3-morpholin-4-ylphenyl)-3-(2-phenyl-1,3-thiazol-4-yl)propanamide
SMILESO=C(CCc1csc(-c2ccccc2)n1)Nc1cccc(N2CCOCC2)c1
InChIInChI=1S/C22H23N3O2S/c26-21(10-9-19-16-28-22(24-19)17-5-2-1-3-6-17)23-18-7-4-8-20(15-18)25-11-13-27-14-12-25/h1-8,15-16H,9-14H2,(H,23,26)
InChIKeyQEGVAXLSAPAPRR-UHFFFAOYSA-N
MW393.51 g/mol
LogP4.22
Rot. Bonds6

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

N-(3-morpholin-4-ylphenyl)-3-(2-phenyl-1,3-thiazol-4-yl)propanamide (PubChem CID 110426324) has the molecular formula C22H23N3O2S and a molecular weight of 393.51 g/mol. Its IUPAC name is N-(3-morpholin-4-ylphenyl)-3-(2-phenyl-1,3-thiazol-4-yl)propanamide.

Molecular Properties

Compound NameN-(3-morpholin-4-ylphenyl)-3-(2-phenyl-1,3-thiazol-4-yl)propanamide
PubChem CID110426324
Molecular FormulaC22H23N3O2S
Molecular Weight393.51 g/mol
Exact Mass393.15
IUPAC NameN-(3-morpholin-4-ylphenyl)-3-(2-phenyl-1,3-thiazol-4-yl)propanamide
SMILESO=C(CCc1csc(-c2ccccc2)n1)Nc1cccc(N2CCOCC2)c1
InChIInChI=1S/C22H23N3O2S/c26-21(10-9-19-16-28-22(24-19)17-5-2-1-3-6-17)23-18-7-4-8-20(15-18)25-11-13-27-14-12-25/h1-8,15-16H,9-14H2,(H,23,26)
InChIKeyQEGVAXLSAPAPRR-UHFFFAOYSA-N
XLogP4.22
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.51
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2-phenyl-1,3-thiazol-4-yl)propanamide
CID 110332912
3-(2-hydroxyphenyl)-N-(3-morpholin-4-ylphenyl)propanamide
CID 71938578
2-[2-(3-bromophenyl)-1,3-thiazol-4-yl]-N-(3-pyrrolidin-1-ylphenyl)acetamide
CID 55812136
N-[2-(3-morpholin-4-ylanilino)-2-oxoethyl]-2-phenylacetamide
CID 87042458
N-(3-hydroxyphenyl)-2-(2-phenyl-1,3-thiazol-4-yl)acetamide
CID 78783427
1-(4-phenylpiperazin-1-yl)-3-(2-pyridin-4-yl-1,3-thiazol-4-yl)propan-1-one
CID 110330015
3-(2-pyridin-4-yl-1,3-thiazol-4-yl)-N-[3-(trifluoromethyl)phenyl]propanamide
CID 110330068
2-(5-methyl-1,2-oxazol-3-yl)-N-(3-morpholin-4-ylphenyl)acetamide
CID 110612975
methyl 3-[3-(2-pyridin-4-yl-1,3-thiazol-4-yl)propanoylamino]benzoate
CID 110330071
N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)-2-(2-phenyl-1,3-thiazol-4-yl)acetamide
CID 4839878
N-[2-[2-(3-acetamidophenyl)-1,3-thiazol-4-yl]ethyl]morpholine-4-carboxamide
CID 110351972
2-(5-methyl-1,2,4-oxadiazol-3-yl)-N-(3-morpholin-4-ylphenyl)acetamide
CID 110612977

Frequently Asked Questions

What is the IUPAC name of N-(3-morpholin-4-ylphenyl)-3-(2-phenyl-1,3-thiazol-4-yl)propanamide?
The IUPAC name of N-(3-morpholin-4-ylphenyl)-3-(2-phenyl-1,3-thiazol-4-yl)propanamide (CID 110426324) is N-(3-morpholin-4-ylphenyl)-3-(2-phenyl-1,3-thiazol-4-yl)propanamide.
What is the SMILES notation for N-(3-morpholin-4-ylphenyl)-3-(2-phenyl-1,3-thiazol-4-yl)propanamide?
The canonical SMILES for N-(3-morpholin-4-ylphenyl)-3-(2-phenyl-1,3-thiazol-4-yl)propanamide is O=C(CCc1csc(-c2ccccc2)n1)Nc1cccc(N2CCOCC2)c1.
What is the InChIKey of N-(3-morpholin-4-ylphenyl)-3-(2-phenyl-1,3-thiazol-4-yl)propanamide?
The InChIKey is QEGVAXLSAPAPRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O2S/c26-21(10-9-19-16-28-22(24-19)17-5-2-1-3-6-17)23-18-7-4-8-20(15-18)25-11-13-27-14-12-25/h1-8,15-16H,9-14H2,(H,23,26).
What are the key properties of N-(3-morpholin-4-ylphenyl)-3-(2-phenyl-1,3-thiazol-4-yl)propanamide?
N-(3-morpholin-4-ylphenyl)-3-(2-phenyl-1,3-thiazol-4-yl)propanamide has a molecular weight of 393.51 g/mol, XLogP of 4.22, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-morpholin-4-ylphenyl)-3-(2-phenyl-1,3-thiazol-4-yl)propanamide is sourced from PubChem (CID 110426324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).