2-(2-butan-2-ylphenoxy)-N-(3-morpholin-4-ylphenyl)acetamide

C22H28N2O3 — CID 55952307

IUPAC2-(2-butan-2-ylphenoxy)-N-(3-morpholin-4-ylphenyl)acetamide
SMILESCCC(C)c1ccccc1OCC(=O)Nc1cccc(N2CCOCC2)c1
InChIInChI=1S/C22H28N2O3/c1-3-17(2)20-9-4-5-10-21(20)27-16-22(25)23-18-7-6-8-19(15-18)24-11-13-26-14-12-24/h4-10,15,17H,3,11-14,16H2,1-2H3,(H,23,25)
InChIKeyHCQCMQWSIOFWTF-UHFFFAOYSA-N
MW368.48 g/mol
LogP4.05
Rot. Bonds7

About 2-(2-butan-2-ylphenoxy)-N-(3-morpholin-4-ylphenyl)acetamide

2-(2-butan-2-ylphenoxy)-N-(3-morpholin-4-ylphenyl)acetamide (PubChem CID 55952307) has the molecular formula C22H28N2O3 and a molecular weight of 368.48 g/mol. Its IUPAC name is 2-(2-butan-2-ylphenoxy)-N-(3-morpholin-4-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(2-butan-2-ylphenoxy)-N-(3-morpholin-4-ylphenyl)acetamide
PubChem CID55952307
Molecular FormulaC22H28N2O3
Molecular Weight368.48 g/mol
Exact Mass368.21
IUPAC Name2-(2-butan-2-ylphenoxy)-N-(3-morpholin-4-ylphenyl)acetamide
SMILESCCC(C)c1ccccc1OCC(=O)Nc1cccc(N2CCOCC2)c1
InChIInChI=1S/C22H28N2O3/c1-3-17(2)20-9-4-5-10-21(20)27-16-22(25)23-18-7-6-8-19(15-18)24-11-13-26-14-12-24/h4-10,15,17H,3,11-14,16H2,1-2H3,(H,23,25)
InChIKeyHCQCMQWSIOFWTF-UHFFFAOYSA-N
XLogP4.05
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.48
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-butan-2-ylphenoxy)-N-(3-propan-2-yloxyphenyl)acetamide
CID 17154653
N-[3-(6-morpholin-4-ylpyridazin-3-yl)phenyl]-2-(2-propan-2-ylphenoxy)acetamide
CID 43991919
2-(2-butan-2-ylphenoxy)-N-(4-fluorophenyl)acetamide
CID 2950014
2-[2-[(2S)-butan-2-yl]phenoxy]-N-(4-methylphenyl)acetamide
CID 833563
2-[2-[(2R)-butan-2-yl]phenoxy]-N-(4-methylphenyl)acetamide
CID 833562
2-(2-butan-2-ylphenoxy)-N-[(3-morpholin-4-ylthiolan-3-yl)methyl]acetamide
CID 55658478
N-(3-amino-4-chlorophenyl)-2-(2-butan-2-ylphenoxy)acetamide
CID 46735825
N-(4-morpholin-4-ylphenyl)-2-(2-propanoylphenoxy)acetamide
CID 2467189
2-[2-[(2S)-butan-2-yl]phenoxy]-N-(4-methoxyphenyl)acetamide
CID 922510
2-(2-butan-2-ylphenoxy)-N-(4-propan-2-yloxyphenyl)acetamide
CID 17340192
2-[2-[(2R)-butan-2-yl]phenoxy]-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide
CID 1015338
2-(2-butan-2-ylphenoxy)-N-[3-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]acetamide
CID 55826048

Frequently Asked Questions

What is the IUPAC name of 2-(2-butan-2-ylphenoxy)-N-(3-morpholin-4-ylphenyl)acetamide?
The IUPAC name of 2-(2-butan-2-ylphenoxy)-N-(3-morpholin-4-ylphenyl)acetamide (CID 55952307) is 2-(2-butan-2-ylphenoxy)-N-(3-morpholin-4-ylphenyl)acetamide.
What is the SMILES notation for 2-(2-butan-2-ylphenoxy)-N-(3-morpholin-4-ylphenyl)acetamide?
The canonical SMILES for 2-(2-butan-2-ylphenoxy)-N-(3-morpholin-4-ylphenyl)acetamide is CCC(C)c1ccccc1OCC(=O)Nc1cccc(N2CCOCC2)c1.
What is the InChIKey of 2-(2-butan-2-ylphenoxy)-N-(3-morpholin-4-ylphenyl)acetamide?
The InChIKey is HCQCMQWSIOFWTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O3/c1-3-17(2)20-9-4-5-10-21(20)27-16-22(25)23-18-7-6-8-19(15-18)24-11-13-26-14-12-24/h4-10,15,17H,3,11-14,16H2,1-2H3,(H,23,25).
What are the key properties of 2-(2-butan-2-ylphenoxy)-N-(3-morpholin-4-ylphenyl)acetamide?
2-(2-butan-2-ylphenoxy)-N-(3-morpholin-4-ylphenyl)acetamide has a molecular weight of 368.48 g/mol, XLogP of 4.05, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-butan-2-ylphenoxy)-N-(3-morpholin-4-ylphenyl)acetamide is sourced from PubChem (CID 55952307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).