N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-2-(2-propan-2-ylphenoxy)acetamide

C21H28N2O3S — CID 4964222

IUPACN-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-2-(2-propan-2-ylphenoxy)acetamide
SMILESCC(C)c1ccccc1OCC(=O)NCC(c1cccs1)N1CCOCC1
InChIInChI=1S/C21H28N2O3S/c1-16(2)17-6-3-4-7-19(17)26-15-21(24)22-14-18(20-8-5-13-27-20)23-9-11-25-12-10-23/h3-8,13,16,18H,9-12,14-15H2,1-2H3,(H,22,24)
InChIKeyXIHVZWMGEKTROA-UHFFFAOYSA-N
MW388.53 g/mol
LogP3.44
Rot. Bonds8

About N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-2-(2-propan-2-ylphenoxy)acetamide

N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-2-(2-propan-2-ylphenoxy)acetamide (PubChem CID 4964222) has the molecular formula C21H28N2O3S and a molecular weight of 388.53 g/mol. Its IUPAC name is N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-2-(2-propan-2-ylphenoxy)acetamide.

Molecular Properties

Compound NameN-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-2-(2-propan-2-ylphenoxy)acetamide
PubChem CID4964222
Molecular FormulaC21H28N2O3S
Molecular Weight388.53 g/mol
Exact Mass388.18
IUPAC NameN-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-2-(2-propan-2-ylphenoxy)acetamide
SMILESCC(C)c1ccccc1OCC(=O)NCC(c1cccs1)N1CCOCC1
InChIInChI=1S/C21H28N2O3S/c1-16(2)17-6-3-4-7-19(17)26-15-21(24)22-14-18(20-8-5-13-27-20)23-9-11-25-12-10-23/h3-8,13,16,18H,9-12,14-15H2,1-2H3,(H,22,24)
InChIKeyXIHVZWMGEKTROA-UHFFFAOYSA-N
XLogP3.44
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.53
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

RU-Ski 43
CID 46006640
[2-[(2-Methoxyphenyl)methylamino]-2-oxoethyl] 2-thiophen-2-ylacetate
CID 2385440
N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-2-oxochromene-3-carboxamide
CID 4124262
2-(4-methylphenoxy)-N-[(thiophen-2-yl)methyl]acetamide
CID 2092599
4-(4-Methoxy-phenyl)-thiophene-2-carboxylic acid (2-morpholin-4-yl-ethyl)-amide
CID 3649035
N-ethyl-2-(4-methylphenoxy)-N-[(5-methylthiophen-2-yl)methyl]acetamide
CID 67510513
N-cyclopropyl-2-(4-methylphenoxy)-N-(thiophen-2-ylmethyl)acetamide
CID 67510848
N-ethyl-2-(3-methylphenoxy)-N-(thiophen-2-ylmethyl)acetamide
CID 67510929
N-ethyl-2-(4-methylphenoxy)-N-(thiophen-3-ylmethyl)acetamide
CID 67510971
N-methyl-2-(4-methylphenoxy)-N-(thiophen-2-ylmethyl)acetamide
CID 67511212
N-ethyl-2-(2-methylphenoxy)-N-(thiophen-2-ylmethyl)acetamide
CID 67511310
2-(4-methylphenoxy)-N-propyl-N-(thiophen-2-ylmethyl)acetamide
CID 67511470

Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-2-(2-propan-2-ylphenoxy)acetamide?
The IUPAC name of N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-2-(2-propan-2-ylphenoxy)acetamide (CID 4964222) is N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-2-(2-propan-2-ylphenoxy)acetamide.
What is the SMILES notation for N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-2-(2-propan-2-ylphenoxy)acetamide?
The canonical SMILES for N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-2-(2-propan-2-ylphenoxy)acetamide is CC(C)c1ccccc1OCC(=O)NCC(c1cccs1)N1CCOCC1.
What is the InChIKey of N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-2-(2-propan-2-ylphenoxy)acetamide?
The InChIKey is XIHVZWMGEKTROA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H28N2O3S/c1-16(2)17-6-3-4-7-19(17)26-15-21(24)22-14-18(20-8-5-13-27-20)23-9-11-25-12-10-23/h3-8,13,16,18H,9-12,14-15H2,1-2H3,(H,22,24).
What are the key properties of N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-2-(2-propan-2-ylphenoxy)acetamide?
N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-2-(2-propan-2-ylphenoxy)acetamide has a molecular weight of 388.53 g/mol, XLogP of 3.44, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-2-(2-propan-2-ylphenoxy)acetamide is sourced from PubChem (CID 4964222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).