2-(4-anilinophenoxy)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]acetamide

C26H29N3O3 — CID 24652273

IUPAC2-(4-anilinophenoxy)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]acetamide
SMILESO=C(COc1ccc(Nc2ccccc2)cc1)NCc1ccc(CN2CCOCC2)cc1
InChIInChI=1S/C26H29N3O3/c30-26(20-32-25-12-10-24(11-13-25)28-23-4-2-1-3-5-23)27-18-21-6-8-22(9-7-21)19-29-14-16-31-17-15-29/h1-13,28H,14-20H2,(H,27,30)
InChIKeyGHJHUOQICLCLCA-UHFFFAOYSA-N
MW431.54 g/mol
LogP3.96
Rot. Bonds9

About 2-(4-anilinophenoxy)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]acetamide

2-(4-anilinophenoxy)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]acetamide (PubChem CID 24652273) has the molecular formula C26H29N3O3 and a molecular weight of 431.54 g/mol. Its IUPAC name is 2-(4-anilinophenoxy)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]acetamide.

Molecular Properties

Compound Name2-(4-anilinophenoxy)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]acetamide
PubChem CID24652273
Molecular FormulaC26H29N3O3
Molecular Weight431.54 g/mol
Exact Mass431.22
IUPAC Name2-(4-anilinophenoxy)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]acetamide
SMILESO=C(COc1ccc(Nc2ccccc2)cc1)NCc1ccc(CN2CCOCC2)cc1
InChIInChI=1S/C26H29N3O3/c30-26(20-32-25-12-10-24(11-13-25)28-23-4-2-1-3-5-23)27-18-21-6-8-22(9-7-21)19-29-14-16-31-17-15-29/h1-13,28H,14-20H2,(H,27,30)
InChIKeyGHJHUOQICLCLCA-UHFFFAOYSA-N
XLogP3.96
TPSA62.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500431.54
LogP ≤ 53.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[3-(morpholin-4-ylmethyl)phenyl]methyl]-2-(4-phenylmethoxyphenoxy)acetamide
CID 55970132
2-(4-iodophenoxy)-N-[[3-(morpholin-4-ylmethyl)phenyl]methyl]acetamide
CID 55969614
2-[4-(morpholin-4-ylmethyl)phenoxy]acetic acid;hydrochloride
CID 46736007
2-(4-chlorophenoxy)-N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]acetamide
CID 8544780
[2-[4-(morpholin-4-ylmethyl)anilino]-2-oxoethyl] 2-(4-phenylmethoxyphenoxy)acetate
CID 24518315
4-(4-methoxyphenoxy)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]butanamide
CID 27890430
2-(4-methylphenoxy)-N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]acetamide
CID 38743222
N-benzyl-4-(morpholin-4-ylmethyl)benzamide
CID 786772
N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-2-(4-propanoylphenoxy)acetamide
CID 51207835
2-[4-(4-cyanophenyl)phenoxy]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide
CID 18230254
(3R)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-3-phenylbutanamide
CID 26008683
2-(4-methylphenoxy)-N-[[4-(morpholin-4-ylmethyl)phenyl]carbamothioyl]acetamide
CID 3511248

Frequently Asked Questions

What is the IUPAC name of 2-(4-anilinophenoxy)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]acetamide?
The IUPAC name of 2-(4-anilinophenoxy)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]acetamide (CID 24652273) is 2-(4-anilinophenoxy)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]acetamide.
What is the SMILES notation for 2-(4-anilinophenoxy)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]acetamide?
The canonical SMILES for 2-(4-anilinophenoxy)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]acetamide is O=C(COc1ccc(Nc2ccccc2)cc1)NCc1ccc(CN2CCOCC2)cc1.
What is the InChIKey of 2-(4-anilinophenoxy)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]acetamide?
The InChIKey is GHJHUOQICLCLCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H29N3O3/c30-26(20-32-25-12-10-24(11-13-25)28-23-4-2-1-3-5-23)27-18-21-6-8-22(9-7-21)19-29-14-16-31-17-15-29/h1-13,28H,14-20H2,(H,27,30).
What are the key properties of 2-(4-anilinophenoxy)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]acetamide?
2-(4-anilinophenoxy)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]acetamide has a molecular weight of 431.54 g/mol, XLogP of 3.96, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-anilinophenoxy)-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]acetamide is sourced from PubChem (CID 24652273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).