4-(4-ethoxyphenyl)-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]-4-oxobutanamide

C25H32N2O4 — CID 9144519

IUPAC4-(4-ethoxyphenyl)-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]-4-oxobutanamide
SMILESCCOc1ccc(C(=O)CCC(=O)N[C@@H](CN2CCOCC2)c2ccc(C)cc2)cc1
InChIInChI=1S/C25H32N2O4/c1-3-31-22-10-8-21(9-11-22)24(28)12-13-25(29)26-23(18-27-14-16-30-17-15-27)20-6-4-19(2)5-7-20/h4-11,23H,3,12-18H2,1-2H3,(H,26,29)/t23-/m0/s1
InChIKeyGELTUXGDFGPCMQ-QHCPKHFHSA-N
MW424.54 g/mol
LogP3.55
Rot. Bonds10

About 4-(4-ethoxyphenyl)-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]-4-oxobutanamide

4-(4-ethoxyphenyl)-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]-4-oxobutanamide (PubChem CID 9144519) has the molecular formula C25H32N2O4 and a molecular weight of 424.54 g/mol. Its IUPAC name is 4-(4-ethoxyphenyl)-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]-4-oxobutanamide.

Molecular Properties

Compound Name4-(4-ethoxyphenyl)-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]-4-oxobutanamide
PubChem CID9144519
Molecular FormulaC25H32N2O4
Molecular Weight424.54 g/mol
Exact Mass424.24
IUPAC Name4-(4-ethoxyphenyl)-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]-4-oxobutanamide
SMILESCCOc1ccc(C(=O)CCC(=O)N[C@@H](CN2CCOCC2)c2ccc(C)cc2)cc1
InChIInChI=1S/C25H32N2O4/c1-3-31-22-10-8-21(9-11-22)24(28)12-13-25(29)26-23(18-27-14-16-30-17-15-27)20-6-4-19(2)5-7-20/h4-11,23H,3,12-18H2,1-2H3,(H,26,29)/t23-/m0/s1
InChIKeyGELTUXGDFGPCMQ-QHCPKHFHSA-N
XLogP3.55
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.54
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-methoxyphenoxy)-N-[(1S)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]acetamide
CID 9144531
N-[(1S)-2-morpholin-4-yl-1-phenylethyl]-4-oxo-4-phenylbutanamide
CID 9149359
4-ethoxy-N-[2-[[(1R)-2-morpholin-4-yl-1-phenylethyl]amino]-2-oxoethyl]benzamide
CID 9149139
4-(4-fluorophenyl)-N-[(1R)-2-morpholin-4-yl-1-phenylethyl]-4-oxobutanamide
CID 9148546
2-(3,4-dimethylphenoxy)-N-[1-(4-methylphenyl)-2-morpholin-4-ylethyl]acetamide
CID 24505048
N-[(1S)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]-2-naphthalen-2-yloxyacetamide
CID 9144499
2-(2,6-dimethylphenoxy)-N-[(1S)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]acetamide
CID 9144717
3-(4-fluorophenyl)-N-[(1S)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]propanamide
CID 9144843
N-[(1S)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]-4-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzamide
CID 31420066
N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]-2-thiophen-2-ylacetamide
CID 51925350
3,4-dimethyl-N-[(1S)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]benzamide
CID 9144477
2-(2-chloro-5-methylphenoxy)-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]acetamide
CID 9144641

Frequently Asked Questions

What is the IUPAC name of 4-(4-ethoxyphenyl)-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]-4-oxobutanamide?
The IUPAC name of 4-(4-ethoxyphenyl)-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]-4-oxobutanamide (CID 9144519) is 4-(4-ethoxyphenyl)-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]-4-oxobutanamide.
What is the SMILES notation for 4-(4-ethoxyphenyl)-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]-4-oxobutanamide?
The canonical SMILES for 4-(4-ethoxyphenyl)-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]-4-oxobutanamide is CCOc1ccc(C(=O)CCC(=O)N[C@@H](CN2CCOCC2)c2ccc(C)cc2)cc1.
What is the InChIKey of 4-(4-ethoxyphenyl)-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]-4-oxobutanamide?
The InChIKey is GELTUXGDFGPCMQ-QHCPKHFHSA-N. The full InChI is InChI=1S/C25H32N2O4/c1-3-31-22-10-8-21(9-11-22)24(28)12-13-25(29)26-23(18-27-14-16-30-17-15-27)20-6-4-19(2)5-7-20/h4-11,23H,3,12-18H2,1-2H3,(H,26,29)/t23-/m0/s1.
What are the key properties of 4-(4-ethoxyphenyl)-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]-4-oxobutanamide?
4-(4-ethoxyphenyl)-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]-4-oxobutanamide has a molecular weight of 424.54 g/mol, XLogP of 3.55, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-ethoxyphenyl)-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]-4-oxobutanamide is sourced from PubChem (CID 9144519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).