3-ethoxy-4-methoxy-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylbenzamide

C23H25NO4 — CID 43012781

IUPAC3-ethoxy-4-methoxy-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylbenzamide
SMILESCCOc1cc(C(=O)N(C)Cc2ccc3cc(OC)ccc3c2)ccc1OC
InChIInChI=1S/C23H25NO4/c1-5-28-22-14-19(9-11-21(22)27-4)23(25)24(2)15-16-6-7-18-13-20(26-3)10-8-17(18)12-16/h6-14H,5,15H2,1-4H3
InChIKeyMWVRTJOPSLKAKR-UHFFFAOYSA-N
MW379.46 g/mol
LogP4.53
Rot. Bonds7

About 3-ethoxy-4-methoxy-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylbenzamide

3-ethoxy-4-methoxy-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylbenzamide (PubChem CID 43012781) has the molecular formula C23H25NO4 and a molecular weight of 379.46 g/mol. Its IUPAC name is 3-ethoxy-4-methoxy-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylbenzamide.

Molecular Properties

Compound Name3-ethoxy-4-methoxy-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylbenzamide
PubChem CID43012781
Molecular FormulaC23H25NO4
Molecular Weight379.46 g/mol
Exact Mass379.18
IUPAC Name3-ethoxy-4-methoxy-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylbenzamide
SMILESCCOc1cc(C(=O)N(C)Cc2ccc3cc(OC)ccc3c2)ccc1OC
InChIInChI=1S/C23H25NO4/c1-5-28-22-14-19(9-11-21(22)27-4)23(25)24(2)15-16-6-7-18-13-20(26-3)10-8-17(18)12-16/h6-14H,5,15H2,1-4H3
InChIKeyMWVRTJOPSLKAKR-UHFFFAOYSA-N
XLogP4.53
TPSA48.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.46
LogP ≤ 54.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 3-ethoxy-4-methoxy-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylbenzamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-4-methoxy-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylbenzamide?
The IUPAC name of 3-ethoxy-4-methoxy-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylbenzamide (CID 43012781) is 3-ethoxy-4-methoxy-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylbenzamide.
What is the SMILES notation for 3-ethoxy-4-methoxy-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylbenzamide?
The canonical SMILES for 3-ethoxy-4-methoxy-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylbenzamide is CCOc1cc(C(=O)N(C)Cc2ccc3cc(OC)ccc3c2)ccc1OC.
What is the InChIKey of 3-ethoxy-4-methoxy-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylbenzamide?
The InChIKey is MWVRTJOPSLKAKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25NO4/c1-5-28-22-14-19(9-11-21(22)27-4)23(25)24(2)15-16-6-7-18-13-20(26-3)10-8-17(18)12-16/h6-14H,5,15H2,1-4H3.
What are the key properties of 3-ethoxy-4-methoxy-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylbenzamide?
3-ethoxy-4-methoxy-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylbenzamide has a molecular weight of 379.46 g/mol, XLogP of 4.53, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-4-methoxy-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylbenzamide is sourced from PubChem (CID 43012781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).