2-(2,4-dimethoxyphenyl)-N-[1-[2-[2-(dimethylamino)-2-oxoethoxy]phenyl]propyl]acetamide

C23H30N2O5 — CID 55901043

IUPAC2-(2,4-dimethoxyphenyl)-N-[1-[2-[2-(dimethylamino)-2-oxoethoxy]phenyl]propyl]acetamide
SMILESCCC(NC(=O)Cc1ccc(OC)cc1OC)c1ccccc1OCC(=O)N(C)C
InChIInChI=1S/C23H30N2O5/c1-6-19(18-9-7-8-10-20(18)30-15-23(27)25(2)3)24-22(26)13-16-11-12-17(28-4)14-21(16)29-5/h7-12,14,19H,6,13,15H2,1-5H3,(H,24,26)
InChIKeyPCUZWZIZZHNYGU-UHFFFAOYSA-N
MW414.50 g/mol
LogP2.98
Rot. Bonds10

About 2-(2,4-dimethoxyphenyl)-N-[1-[2-[2-(dimethylamino)-2-oxoethoxy]phenyl]propyl]acetamide

2-(2,4-dimethoxyphenyl)-N-[1-[2-[2-(dimethylamino)-2-oxoethoxy]phenyl]propyl]acetamide (PubChem CID 55901043) has the molecular formula C23H30N2O5 and a molecular weight of 414.50 g/mol. Its IUPAC name is 2-(2,4-dimethoxyphenyl)-N-[1-[2-[2-(dimethylamino)-2-oxoethoxy]phenyl]propyl]acetamide.

Molecular Properties

Compound Name2-(2,4-dimethoxyphenyl)-N-[1-[2-[2-(dimethylamino)-2-oxoethoxy]phenyl]propyl]acetamide
PubChem CID55901043
Molecular FormulaC23H30N2O5
Molecular Weight414.50 g/mol
Exact Mass414.22
IUPAC Name2-(2,4-dimethoxyphenyl)-N-[1-[2-[2-(dimethylamino)-2-oxoethoxy]phenyl]propyl]acetamide
SMILESCCC(NC(=O)Cc1ccc(OC)cc1OC)c1ccccc1OCC(=O)N(C)C
InChIInChI=1S/C23H30N2O5/c1-6-19(18-9-7-8-10-20(18)30-15-23(27)25(2)3)24-22(26)13-16-11-12-17(28-4)14-21(16)29-5/h7-12,14,19H,6,13,15H2,1-5H3,(H,24,26)
InChIKeyPCUZWZIZZHNYGU-UHFFFAOYSA-N
XLogP2.98
TPSA77.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.50
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-[2-[2-(dimethylamino)-2-oxoethoxy]phenyl]propyl]-2-(3,4,5-trimethoxyphenyl)acetamide
CID 55902697
N-[1-[2-[2-(dimethylamino)-2-oxoethoxy]phenyl]propyl]-2-(4-methoxyphenoxy)propanamide
CID 55902579
N-[1-[2-[2-(dimethylamino)-2-oxoethoxy]phenyl]propyl]-3-ethoxy-4-methoxybenzamide
CID 55901936
N-[1-[2-[2-(dimethylamino)-2-oxoethoxy]phenyl]propyl]-2-(2-nitrophenyl)acetamide
CID 60534764
4-(2-amino-2-oxoethoxy)-N-[1-[2-[2-(dimethylamino)-2-oxoethoxy]phenyl]propyl]-3,5-dimethoxybenzamide
CID 55902194
N-[1-[2-[2-(dimethylamino)-2-oxoethoxy]phenyl]propyl]-3-methoxy-4-(3-methylbutoxy)benzamide
CID 55901041
6-[1-[2-[2-(dimethylamino)-2-oxoethoxy]phenyl]propylcarbamoyl]pyridine-2-carboxylic acid
CID 119180806
3-[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]-N-[1-[2-[2-(dimethylamino)-2-oxoethoxy]phenyl]propyl]prop-2-enamide
CID 55992224
2-[2-[(1S)-1-hydroxyethyl]-5-methoxyphenoxy]-N,N-dimethylacetamide
CID 82002018
N,N-dimethyl-2-[2-[1-[[2-[2-(4-methylanilino)-2-oxoethyl]sulfanylacetyl]amino]propyl]phenoxy]acetamide
CID 55902568
2-[2-[1-[[2-[(4-cyanophenyl)methylsulfanyl]acetyl]amino]propyl]phenoxy]-N,N-dimethylacetamide
CID 55900922
N-[1-[2-[2-(dimethylamino)-2-oxoethoxy]phenyl]propyl]-3-[(4-fluorophenyl)methoxy]benzamide
CID 55901297

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethoxyphenyl)-N-[1-[2-[2-(dimethylamino)-2-oxoethoxy]phenyl]propyl]acetamide?
The IUPAC name of 2-(2,4-dimethoxyphenyl)-N-[1-[2-[2-(dimethylamino)-2-oxoethoxy]phenyl]propyl]acetamide (CID 55901043) is 2-(2,4-dimethoxyphenyl)-N-[1-[2-[2-(dimethylamino)-2-oxoethoxy]phenyl]propyl]acetamide.
What is the SMILES notation for 2-(2,4-dimethoxyphenyl)-N-[1-[2-[2-(dimethylamino)-2-oxoethoxy]phenyl]propyl]acetamide?
The canonical SMILES for 2-(2,4-dimethoxyphenyl)-N-[1-[2-[2-(dimethylamino)-2-oxoethoxy]phenyl]propyl]acetamide is CCC(NC(=O)Cc1ccc(OC)cc1OC)c1ccccc1OCC(=O)N(C)C.
What is the InChIKey of 2-(2,4-dimethoxyphenyl)-N-[1-[2-[2-(dimethylamino)-2-oxoethoxy]phenyl]propyl]acetamide?
The InChIKey is PCUZWZIZZHNYGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N2O5/c1-6-19(18-9-7-8-10-20(18)30-15-23(27)25(2)3)24-22(26)13-16-11-12-17(28-4)14-21(16)29-5/h7-12,14,19H,6,13,15H2,1-5H3,(H,24,26).
What are the key properties of 2-(2,4-dimethoxyphenyl)-N-[1-[2-[2-(dimethylamino)-2-oxoethoxy]phenyl]propyl]acetamide?
2-(2,4-dimethoxyphenyl)-N-[1-[2-[2-(dimethylamino)-2-oxoethoxy]phenyl]propyl]acetamide has a molecular weight of 414.50 g/mol, XLogP of 2.98, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethoxyphenyl)-N-[1-[2-[2-(dimethylamino)-2-oxoethoxy]phenyl]propyl]acetamide is sourced from PubChem (CID 55901043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).