N-[3-(diethylaminomethyl)phenyl]-3-(3,4,5-trimethoxyphenyl)propanamide

C23H32N2O4 — CID 55602062

IUPACN-[3-(diethylaminomethyl)phenyl]-3-(3,4,5-trimethoxyphenyl)propanamide
SMILESCCN(CC)Cc1cccc(NC(=O)CCc2cc(OC)c(OC)c(OC)c2)c1
InChIInChI=1S/C23H32N2O4/c1-6-25(7-2)16-18-9-8-10-19(13-18)24-22(26)12-11-17-14-20(27-3)23(29-5)21(15-17)28-4/h8-10,13-15H,6-7,11-12,16H2,1-5H3,(H,24,26)
InChIKeySAFOVHUHDDKACX-UHFFFAOYSA-N
MW400.52 g/mol
LogP4.13
Rot. Bonds11

About N-[3-(diethylaminomethyl)phenyl]-3-(3,4,5-trimethoxyphenyl)propanamide

N-[3-(diethylaminomethyl)phenyl]-3-(3,4,5-trimethoxyphenyl)propanamide (PubChem CID 55602062) has the molecular formula C23H32N2O4 and a molecular weight of 400.52 g/mol. Its IUPAC name is N-[3-(diethylaminomethyl)phenyl]-3-(3,4,5-trimethoxyphenyl)propanamide.

Molecular Properties

Compound NameN-[3-(diethylaminomethyl)phenyl]-3-(3,4,5-trimethoxyphenyl)propanamide
PubChem CID55602062
Molecular FormulaC23H32N2O4
Molecular Weight400.52 g/mol
Exact Mass400.24
IUPAC NameN-[3-(diethylaminomethyl)phenyl]-3-(3,4,5-trimethoxyphenyl)propanamide
SMILESCCN(CC)Cc1cccc(NC(=O)CCc2cc(OC)c(OC)c(OC)c2)c1
InChIInChI=1S/C23H32N2O4/c1-6-25(7-2)16-18-9-8-10-19(13-18)24-22(26)12-11-17-14-20(27-3)23(29-5)21(15-17)28-4/h8-10,13-15H,6-7,11-12,16H2,1-5H3,(H,24,26)
InChIKeySAFOVHUHDDKACX-UHFFFAOYSA-N
XLogP4.13
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.52
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[3-(diethylaminomethyl)phenyl]-3-(3,4,5-trimethoxyphenyl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(3-methylsulfanylphenyl)-3-(3,4,5-trimethoxyphenyl)propanamide
CID 2665681
N-(3-sulfamoylphenyl)-3-(3,4,5-trimethoxyphenyl)propanamide
CID 9413193
[2-(3-ethylanilino)-2-oxoethyl] 3-(3,4,5-trimethoxyphenyl)propanoate
CID 8019117
N-[3-[3-(diethylaminomethyl)anilino]-3-oxopropyl]-2-methoxybenzamide
CID 46449017
3-phenyl-N-(3,4,5-trimethoxyphenyl)propanamide
CID 2991890
4-amino-N-[3-(diethylaminomethyl)phenyl]butanamide;dihydrochloride
CID 119852879
N-(3-pyrazol-1-ylphenyl)-3-(3,4,5-trimethoxyphenyl)propanamide
CID 55700607
N-[3-(diethylaminomethyl)phenyl]-3,4-dimethoxybenzamide
CID 43073865
6-amino-N-[3-(diethylaminomethyl)phenyl]hexanamide
CID 43711987
N-(3-acetamido-4-methoxyphenyl)-3-(3,4,5-trimethoxyphenyl)propanamide
CID 33307641
N-(4-tert-butylphenyl)-3-(3,4,5-trimethoxyphenyl)propanamide
CID 7914234
2-[3-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]phenyl]acetic acid
CID 119351773

Frequently Asked Questions

What is the IUPAC name of N-[3-(diethylaminomethyl)phenyl]-3-(3,4,5-trimethoxyphenyl)propanamide?
The IUPAC name of N-[3-(diethylaminomethyl)phenyl]-3-(3,4,5-trimethoxyphenyl)propanamide (CID 55602062) is N-[3-(diethylaminomethyl)phenyl]-3-(3,4,5-trimethoxyphenyl)propanamide.
What is the SMILES notation for N-[3-(diethylaminomethyl)phenyl]-3-(3,4,5-trimethoxyphenyl)propanamide?
The canonical SMILES for N-[3-(diethylaminomethyl)phenyl]-3-(3,4,5-trimethoxyphenyl)propanamide is CCN(CC)Cc1cccc(NC(=O)CCc2cc(OC)c(OC)c(OC)c2)c1.
What is the InChIKey of N-[3-(diethylaminomethyl)phenyl]-3-(3,4,5-trimethoxyphenyl)propanamide?
The InChIKey is SAFOVHUHDDKACX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H32N2O4/c1-6-25(7-2)16-18-9-8-10-19(13-18)24-22(26)12-11-17-14-20(27-3)23(29-5)21(15-17)28-4/h8-10,13-15H,6-7,11-12,16H2,1-5H3,(H,24,26).
What are the key properties of N-[3-(diethylaminomethyl)phenyl]-3-(3,4,5-trimethoxyphenyl)propanamide?
N-[3-(diethylaminomethyl)phenyl]-3-(3,4,5-trimethoxyphenyl)propanamide has a molecular weight of 400.52 g/mol, XLogP of 4.13, 11 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(diethylaminomethyl)phenyl]-3-(3,4,5-trimethoxyphenyl)propanamide is sourced from PubChem (CID 55602062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).