N-[4-[[2-(2-tert-butylphenoxy)acetyl]amino]phenyl]-2-morpholin-4-ylacetamide

C24H31N3O4 — CID 24620528

IUPACN-[4-[[2-(2-tert-butylphenoxy)acetyl]amino]phenyl]-2-morpholin-4-ylacetamide
SMILESCC(C)(C)c1ccccc1OCC(=O)Nc1ccc(NC(=O)CN2CCOCC2)cc1
InChIInChI=1S/C24H31N3O4/c1-24(2,3)20-6-4-5-7-21(20)31-17-23(29)26-19-10-8-18(9-11-19)25-22(28)16-27-12-14-30-15-13-27/h4-11H,12-17H2,1-3H3,(H,25,28)(H,26,29)
InChIKeyMYWNIOLOXUHSDD-UHFFFAOYSA-N
MW425.53 g/mol
LogP3.27
Rot. Bonds7

About N-[4-[[2-(2-tert-butylphenoxy)acetyl]amino]phenyl]-2-morpholin-4-ylacetamide

N-[4-[[2-(2-tert-butylphenoxy)acetyl]amino]phenyl]-2-morpholin-4-ylacetamide (PubChem CID 24620528) has the molecular formula C24H31N3O4 and a molecular weight of 425.53 g/mol. Its IUPAC name is N-[4-[[2-(2-tert-butylphenoxy)acetyl]amino]phenyl]-2-morpholin-4-ylacetamide.

Molecular Properties

Compound NameN-[4-[[2-(2-tert-butylphenoxy)acetyl]amino]phenyl]-2-morpholin-4-ylacetamide
PubChem CID24620528
Molecular FormulaC24H31N3O4
Molecular Weight425.53 g/mol
Exact Mass425.23
IUPAC NameN-[4-[[2-(2-tert-butylphenoxy)acetyl]amino]phenyl]-2-morpholin-4-ylacetamide
SMILESCC(C)(C)c1ccccc1OCC(=O)Nc1ccc(NC(=O)CN2CCOCC2)cc1
InChIInChI=1S/C24H31N3O4/c1-24(2,3)20-6-4-5-7-21(20)31-17-23(29)26-19-10-8-18(9-11-19)25-22(28)16-27-12-14-30-15-13-27/h4-11H,12-17H2,1-3H3,(H,25,28)(H,26,29)
InChIKeyMYWNIOLOXUHSDD-UHFFFAOYSA-N
XLogP3.27
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500425.53
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-ethoxyphenoxy)-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide
CID 108754559
4-tert-butyl-N-[4-[[2-(2-tert-butylphenoxy)acetyl]amino]phenyl]benzamide
CID 17235093
2-[13-(2-anilino-2-oxoethyl)-1,4,10-trioxa-7,13-diazacyclopentadec-7-yl]-N-phenylacetamide
CID 649229
2-morpholin-4-yl-N-[4-[(2-phenylmethoxyacetyl)amino]phenyl]acetamide
CID 55505106
ethane;N-(4-methylphenyl)-2-morpholin-4-ylacetamide
CID 142923820
2-(2-methoxyphenoxy)-N-[5-(2-morpholin-4-ylethylamino)-2-pyridinyl]acetamide
CID 113025655
2-(2-chlorophenoxy)-N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]propanamide
CID 42953030
[2-(4-acetamidoanilino)-2-oxoethyl] 2-(2-tert-butylphenoxy)acetate
CID 8701080
2-(2-tert-butylphenoxy)-N-(6-chloro-3-pyridinyl)acetamide
CID 54787974
2-(2-tert-butylphenoxy)-N-[4-(dimethylsulfamoyl)phenyl]acetamide
CID 17050654
4-[2-[2-(2-tert-butylphenoxy)acetyl]hydrazinyl]-4-oxo-N-phenylbutanamide
CID 17050893
4-(4-tert-butylphenoxy)-N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]butanamide
CID 16612050

Frequently Asked Questions

What is the IUPAC name of N-[4-[[2-(2-tert-butylphenoxy)acetyl]amino]phenyl]-2-morpholin-4-ylacetamide?
The IUPAC name of N-[4-[[2-(2-tert-butylphenoxy)acetyl]amino]phenyl]-2-morpholin-4-ylacetamide (CID 24620528) is N-[4-[[2-(2-tert-butylphenoxy)acetyl]amino]phenyl]-2-morpholin-4-ylacetamide.
What is the SMILES notation for N-[4-[[2-(2-tert-butylphenoxy)acetyl]amino]phenyl]-2-morpholin-4-ylacetamide?
The canonical SMILES for N-[4-[[2-(2-tert-butylphenoxy)acetyl]amino]phenyl]-2-morpholin-4-ylacetamide is CC(C)(C)c1ccccc1OCC(=O)Nc1ccc(NC(=O)CN2CCOCC2)cc1.
What is the InChIKey of N-[4-[[2-(2-tert-butylphenoxy)acetyl]amino]phenyl]-2-morpholin-4-ylacetamide?
The InChIKey is MYWNIOLOXUHSDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H31N3O4/c1-24(2,3)20-6-4-5-7-21(20)31-17-23(29)26-19-10-8-18(9-11-19)25-22(28)16-27-12-14-30-15-13-27/h4-11H,12-17H2,1-3H3,(H,25,28)(H,26,29).
What are the key properties of N-[4-[[2-(2-tert-butylphenoxy)acetyl]amino]phenyl]-2-morpholin-4-ylacetamide?
N-[4-[[2-(2-tert-butylphenoxy)acetyl]amino]phenyl]-2-morpholin-4-ylacetamide has a molecular weight of 425.53 g/mol, XLogP of 3.27, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[[2-(2-tert-butylphenoxy)acetyl]amino]phenyl]-2-morpholin-4-ylacetamide is sourced from PubChem (CID 24620528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).