3-(4-ethoxy-3-methoxyphenyl)-N-[4-(morpholin-4-ylmethyl)phenyl]propanamide

C23H30N2O4 — CID 108730938

IUPAC3-(4-ethoxy-3-methoxyphenyl)-N-[4-(morpholin-4-ylmethyl)phenyl]propanamide
SMILESCCOc1ccc(CCC(=O)Nc2ccc(CN3CCOCC3)cc2)cc1OC
InChIInChI=1S/C23H30N2O4/c1-3-29-21-10-6-18(16-22(21)27-2)7-11-23(26)24-20-8-4-19(5-9-20)17-25-12-14-28-15-13-25/h4-6,8-10,16H,3,7,11-15,17H2,1-2H3,(H,24,26)
InChIKeyMKKVYPNZVWTYAV-UHFFFAOYSA-N
MW398.50 g/mol
LogP3.50
Rot. Bonds9

About 3-(4-ethoxy-3-methoxyphenyl)-N-[4-(morpholin-4-ylmethyl)phenyl]propanamide

3-(4-ethoxy-3-methoxyphenyl)-N-[4-(morpholin-4-ylmethyl)phenyl]propanamide (PubChem CID 108730938) has the molecular formula C23H30N2O4 and a molecular weight of 398.50 g/mol. Its IUPAC name is 3-(4-ethoxy-3-methoxyphenyl)-N-[4-(morpholin-4-ylmethyl)phenyl]propanamide.

Molecular Properties

Compound Name3-(4-ethoxy-3-methoxyphenyl)-N-[4-(morpholin-4-ylmethyl)phenyl]propanamide
PubChem CID108730938
Molecular FormulaC23H30N2O4
Molecular Weight398.50 g/mol
Exact Mass398.22
IUPAC Name3-(4-ethoxy-3-methoxyphenyl)-N-[4-(morpholin-4-ylmethyl)phenyl]propanamide
SMILESCCOc1ccc(CCC(=O)Nc2ccc(CN3CCOCC3)cc2)cc1OC
InChIInChI=1S/C23H30N2O4/c1-3-29-21-10-6-18(16-22(21)27-2)7-11-23(26)24-20-8-4-19(5-9-20)17-25-12-14-28-15-13-25/h4-6,8-10,16H,3,7,11-15,17H2,1-2H3,(H,24,26)
InChIKeyMKKVYPNZVWTYAV-UHFFFAOYSA-N
XLogP3.50
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.50
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(4-ethoxy-3-methoxyphenyl)-N-(4-iodophenyl)propanamide
CID 19221776
2-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide
CID 8682147
2-(2-ethoxyphenoxy)-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide
CID 108754559
4-[3-(4-ethoxy-3-methoxyphenyl)propanoylamino]benzenesulfonic acid
CID 4143684
N-[4-(dimethylamino)phenyl]-3-(4-ethoxy-3-methoxyphenyl)propanamide
CID 19221846
4-(5-chloro-2-methoxyphenyl)-N-[4-(morpholin-4-ylmethyl)phenyl]-4-oxobutanamide
CID 108730998
3-(4-ethoxy-3-methoxyphenyl)-N-[4-[[(2,2,2-trifluoroacetyl)amino]methyl]phenyl]propanamide
CID 108933802
N-(3,4-dimethoxyphenyl)-4-(morpholin-4-ylmethyl)benzamide
CID 1099911
2-methoxy-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide
CID 60656764
N-[4-(morpholin-4-ylmethyl)phenyl]octadecanamide
CID 108730937
3-(4-ethoxy-3-methoxyphenyl)-N-ethylpropanamide
CID 58655084
3-(3,4-dimethoxyphenyl)-N-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]propanamide
CID 110668709

Frequently Asked Questions

What is the IUPAC name of 3-(4-ethoxy-3-methoxyphenyl)-N-[4-(morpholin-4-ylmethyl)phenyl]propanamide?
The IUPAC name of 3-(4-ethoxy-3-methoxyphenyl)-N-[4-(morpholin-4-ylmethyl)phenyl]propanamide (CID 108730938) is 3-(4-ethoxy-3-methoxyphenyl)-N-[4-(morpholin-4-ylmethyl)phenyl]propanamide.
What is the SMILES notation for 3-(4-ethoxy-3-methoxyphenyl)-N-[4-(morpholin-4-ylmethyl)phenyl]propanamide?
The canonical SMILES for 3-(4-ethoxy-3-methoxyphenyl)-N-[4-(morpholin-4-ylmethyl)phenyl]propanamide is CCOc1ccc(CCC(=O)Nc2ccc(CN3CCOCC3)cc2)cc1OC.
What is the InChIKey of 3-(4-ethoxy-3-methoxyphenyl)-N-[4-(morpholin-4-ylmethyl)phenyl]propanamide?
The InChIKey is MKKVYPNZVWTYAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N2O4/c1-3-29-21-10-6-18(16-22(21)27-2)7-11-23(26)24-20-8-4-19(5-9-20)17-25-12-14-28-15-13-25/h4-6,8-10,16H,3,7,11-15,17H2,1-2H3,(H,24,26).
What are the key properties of 3-(4-ethoxy-3-methoxyphenyl)-N-[4-(morpholin-4-ylmethyl)phenyl]propanamide?
3-(4-ethoxy-3-methoxyphenyl)-N-[4-(morpholin-4-ylmethyl)phenyl]propanamide has a molecular weight of 398.50 g/mol, XLogP of 3.50, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-ethoxy-3-methoxyphenyl)-N-[4-(morpholin-4-ylmethyl)phenyl]propanamide is sourced from PubChem (CID 108730938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).