N-benzyl-2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-N-(1-morpholin-4-ylpropan-2-yl)acetamide

C23H27N3O3S — CID 56501103

IUPACN-benzyl-2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-N-(1-morpholin-4-ylpropan-2-yl)acetamide
SMILESCC(CN1CCOCC1)N(Cc1ccccc1)C(=O)Cc1csc(-c2ccco2)n1
InChIInChI=1S/C23H27N3O3S/c1-18(15-25-9-12-28-13-10-25)26(16-19-6-3-2-4-7-19)22(27)14-20-17-30-23(24-20)21-8-5-11-29-21/h2-8,11,17-18H,9-10,12-16H2,1H3
InChIKeyZXPNEJWIVUTAEJ-UHFFFAOYSA-N
MW425.55 g/mol
LogP3.70
Rot. Bonds8

About N-benzyl-2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-N-(1-morpholin-4-ylpropan-2-yl)acetamide

N-benzyl-2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-N-(1-morpholin-4-ylpropan-2-yl)acetamide (PubChem CID 56501103) has the molecular formula C23H27N3O3S and a molecular weight of 425.55 g/mol. Its IUPAC name is N-benzyl-2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-N-(1-morpholin-4-ylpropan-2-yl)acetamide.

Molecular Properties

Compound NameN-benzyl-2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-N-(1-morpholin-4-ylpropan-2-yl)acetamide
PubChem CID56501103
Molecular FormulaC23H27N3O3S
Molecular Weight425.55 g/mol
Exact Mass425.18
IUPAC NameN-benzyl-2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-N-(1-morpholin-4-ylpropan-2-yl)acetamide
SMILESCC(CN1CCOCC1)N(Cc1ccccc1)C(=O)Cc1csc(-c2ccco2)n1
InChIInChI=1S/C23H27N3O3S/c1-18(15-25-9-12-28-13-10-25)26(16-19-6-3-2-4-7-19)22(27)14-20-17-30-23(24-20)21-8-5-11-29-21/h2-8,11,17-18H,9-10,12-16H2,1H3
InChIKeyZXPNEJWIVUTAEJ-UHFFFAOYSA-N
XLogP3.70
TPSA58.81 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500425.55
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

N-benzyl-N-(1-morpholin-4-ylpropan-2-yl)-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
CID 56501375
2-(4-aminophenyl)-N-benzyl-N-(1-morpholin-4-ylpropan-2-yl)acetamide;dihydrochloride
CID 119877064
2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-N-(2-hydroxyethyl)-N-propan-2-ylacetamide
CID 43573534
N-benzyl-2-(4-ethoxyphenyl)-N-(1-morpholin-4-ylpropan-2-yl)acetamide
CID 56500857
N-benzyl-N-(1-morpholin-4-ylpropan-2-yl)-2-(4-sulfamoylphenyl)acetamide
CID 56581067
N-benzyl-N-(1-morpholin-4-ylpropan-2-yl)-2-[4-(trifluoromethyl)phenyl]acetamide
CID 56500713
N-benzyl-N-(1-morpholin-4-ylpropan-2-yl)-2-thiophen-3-yl-1,3-thiazole-4-carboxamide
CID 56501664
N-benzyl-4-(methylamino)-N-(1-morpholin-4-ylpropan-2-yl)butanamide
CID 119877069
N-benzyl-4-methyl-2-(5-methylfuran-2-yl)-N-(1-morpholin-4-ylpropan-2-yl)-1,3-thiazole-5-carboxamide
CID 56501633
2-[2-(furan-2-yl)-1,3-thiazol-4-yl]acetic acid
CID 7176378
N-benzyl-2-[(2-chlorophenyl)methoxy]-N-(1-morpholin-4-ylpropan-2-yl)acetamide
CID 56501629
N-benzyl-2-(2-ethylbenzimidazol-1-yl)-N-(1-morpholin-4-ylpropan-2-yl)acetamide
CID 56500579

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-N-(1-morpholin-4-ylpropan-2-yl)acetamide?
The IUPAC name of N-benzyl-2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-N-(1-morpholin-4-ylpropan-2-yl)acetamide (CID 56501103) is N-benzyl-2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-N-(1-morpholin-4-ylpropan-2-yl)acetamide.
What is the SMILES notation for N-benzyl-2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-N-(1-morpholin-4-ylpropan-2-yl)acetamide?
The canonical SMILES for N-benzyl-2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-N-(1-morpholin-4-ylpropan-2-yl)acetamide is CC(CN1CCOCC1)N(Cc1ccccc1)C(=O)Cc1csc(-c2ccco2)n1.
What is the InChIKey of N-benzyl-2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-N-(1-morpholin-4-ylpropan-2-yl)acetamide?
The InChIKey is ZXPNEJWIVUTAEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27N3O3S/c1-18(15-25-9-12-28-13-10-25)26(16-19-6-3-2-4-7-19)22(27)14-20-17-30-23(24-20)21-8-5-11-29-21/h2-8,11,17-18H,9-10,12-16H2,1H3.
What are the key properties of N-benzyl-2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-N-(1-morpholin-4-ylpropan-2-yl)acetamide?
N-benzyl-2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-N-(1-morpholin-4-ylpropan-2-yl)acetamide has a molecular weight of 425.55 g/mol, XLogP of 3.70, 8 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-N-(1-morpholin-4-ylpropan-2-yl)acetamide is sourced from PubChem (CID 56501103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).