N-methyl-2-naphthalen-2-yloxy-N-[(2,3,4-trimethoxyphenyl)methyl]acetamide

C23H25NO5 — CID 26555249

IUPACN-methyl-2-naphthalen-2-yloxy-N-[(2,3,4-trimethoxyphenyl)methyl]acetamide
SMILESCOc1ccc(CN(C)C(=O)COc2ccc3ccccc3c2)c(OC)c1OC
InChIInChI=1S/C23H25NO5/c1-24(14-18-10-12-20(26-2)23(28-4)22(18)27-3)21(25)15-29-19-11-9-16-7-5-6-8-17(16)13-19/h5-13H,14-15H2,1-4H3
InChIKeyQVOGDUTUIYTZGE-UHFFFAOYSA-N
MW395.46 g/mol
LogP3.90
Rot. Bonds8

About N-methyl-2-naphthalen-2-yloxy-N-[(2,3,4-trimethoxyphenyl)methyl]acetamide

N-methyl-2-naphthalen-2-yloxy-N-[(2,3,4-trimethoxyphenyl)methyl]acetamide (PubChem CID 26555249) has the molecular formula C23H25NO5 and a molecular weight of 395.46 g/mol. Its IUPAC name is N-methyl-2-naphthalen-2-yloxy-N-[(2,3,4-trimethoxyphenyl)methyl]acetamide.

Molecular Properties

Compound NameN-methyl-2-naphthalen-2-yloxy-N-[(2,3,4-trimethoxyphenyl)methyl]acetamide
PubChem CID26555249
Molecular FormulaC23H25NO5
Molecular Weight395.46 g/mol
Exact Mass395.17
IUPAC NameN-methyl-2-naphthalen-2-yloxy-N-[(2,3,4-trimethoxyphenyl)methyl]acetamide
SMILESCOc1ccc(CN(C)C(=O)COc2ccc3ccccc3c2)c(OC)c1OC
InChIInChI=1S/C23H25NO5/c1-24(14-18-10-12-20(26-2)23(28-4)22(18)27-3)21(25)15-29-19-11-9-16-7-5-6-8-17(16)13-19/h5-13H,14-15H2,1-4H3
InChIKeyQVOGDUTUIYTZGE-UHFFFAOYSA-N
XLogP3.90
TPSA57.23 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.46
LogP ≤ 53.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-naphthalen-2-yloxy-N-[(2,3,4-trimethoxyphenyl)methyl]acetamide?
The IUPAC name of N-methyl-2-naphthalen-2-yloxy-N-[(2,3,4-trimethoxyphenyl)methyl]acetamide (CID 26555249) is N-methyl-2-naphthalen-2-yloxy-N-[(2,3,4-trimethoxyphenyl)methyl]acetamide.
What is the SMILES notation for N-methyl-2-naphthalen-2-yloxy-N-[(2,3,4-trimethoxyphenyl)methyl]acetamide?
The canonical SMILES for N-methyl-2-naphthalen-2-yloxy-N-[(2,3,4-trimethoxyphenyl)methyl]acetamide is COc1ccc(CN(C)C(=O)COc2ccc3ccccc3c2)c(OC)c1OC.
What is the InChIKey of N-methyl-2-naphthalen-2-yloxy-N-[(2,3,4-trimethoxyphenyl)methyl]acetamide?
The InChIKey is QVOGDUTUIYTZGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25NO5/c1-24(14-18-10-12-20(26-2)23(28-4)22(18)27-3)21(25)15-29-19-11-9-16-7-5-6-8-17(16)13-19/h5-13H,14-15H2,1-4H3.
What are the key properties of N-methyl-2-naphthalen-2-yloxy-N-[(2,3,4-trimethoxyphenyl)methyl]acetamide?
N-methyl-2-naphthalen-2-yloxy-N-[(2,3,4-trimethoxyphenyl)methyl]acetamide has a molecular weight of 395.46 g/mol, XLogP of 3.90, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-naphthalen-2-yloxy-N-[(2,3,4-trimethoxyphenyl)methyl]acetamide is sourced from PubChem (CID 26555249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).