N-[(4-methoxyphenyl)methyl]-N-methyl-2-(1-naphthalen-1-ylethylamino)acetamide

C23H26N2O2 — CID 112800999

IUPACN-[(4-methoxyphenyl)methyl]-N-methyl-2-(1-naphthalen-1-ylethylamino)acetamide
SMILESCOc1ccc(CN(C)C(=O)CNC(C)c2cccc3ccccc23)cc1
InChIInChI=1S/C23H26N2O2/c1-17(21-10-6-8-19-7-4-5-9-22(19)21)24-15-23(26)25(2)16-18-11-13-20(27-3)14-12-18/h4-14,17,24H,15-16H2,1-3H3
InChIKeyBOUJFFAVBNDLKS-UHFFFAOYSA-N
MW362.47 g/mol
LogP4.16
Rot. Bonds7

About N-[(4-methoxyphenyl)methyl]-N-methyl-2-(1-naphthalen-1-ylethylamino)acetamide

N-[(4-methoxyphenyl)methyl]-N-methyl-2-(1-naphthalen-1-ylethylamino)acetamide (PubChem CID 112800999) has the molecular formula C23H26N2O2 and a molecular weight of 362.47 g/mol. Its IUPAC name is N-[(4-methoxyphenyl)methyl]-N-methyl-2-(1-naphthalen-1-ylethylamino)acetamide.

Molecular Properties

Compound NameN-[(4-methoxyphenyl)methyl]-N-methyl-2-(1-naphthalen-1-ylethylamino)acetamide
PubChem CID112800999
Molecular FormulaC23H26N2O2
Molecular Weight362.47 g/mol
Exact Mass362.20
IUPAC NameN-[(4-methoxyphenyl)methyl]-N-methyl-2-(1-naphthalen-1-ylethylamino)acetamide
SMILESCOc1ccc(CN(C)C(=O)CNC(C)c2cccc3ccccc23)cc1
InChIInChI=1S/C23H26N2O2/c1-17(21-10-6-8-19-7-4-5-9-22(19)21)24-15-23(26)25(2)16-18-11-13-20(27-3)14-12-18/h4-14,17,24H,15-16H2,1-3H3
InChIKeyBOUJFFAVBNDLKS-UHFFFAOYSA-N
XLogP4.16
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.47
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(4-methoxyphenyl)methyl]-N-methyl-2-(1-naphthalen-1-ylethylamino)acetamide?
The IUPAC name of N-[(4-methoxyphenyl)methyl]-N-methyl-2-(1-naphthalen-1-ylethylamino)acetamide (CID 112800999) is N-[(4-methoxyphenyl)methyl]-N-methyl-2-(1-naphthalen-1-ylethylamino)acetamide.
What is the SMILES notation for N-[(4-methoxyphenyl)methyl]-N-methyl-2-(1-naphthalen-1-ylethylamino)acetamide?
The canonical SMILES for N-[(4-methoxyphenyl)methyl]-N-methyl-2-(1-naphthalen-1-ylethylamino)acetamide is COc1ccc(CN(C)C(=O)CNC(C)c2cccc3ccccc23)cc1.
What is the InChIKey of N-[(4-methoxyphenyl)methyl]-N-methyl-2-(1-naphthalen-1-ylethylamino)acetamide?
The InChIKey is BOUJFFAVBNDLKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N2O2/c1-17(21-10-6-8-19-7-4-5-9-22(19)21)24-15-23(26)25(2)16-18-11-13-20(27-3)14-12-18/h4-14,17,24H,15-16H2,1-3H3.
What are the key properties of N-[(4-methoxyphenyl)methyl]-N-methyl-2-(1-naphthalen-1-ylethylamino)acetamide?
N-[(4-methoxyphenyl)methyl]-N-methyl-2-(1-naphthalen-1-ylethylamino)acetamide has a molecular weight of 362.47 g/mol, XLogP of 4.16, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methoxyphenyl)methyl]-N-methyl-2-(1-naphthalen-1-ylethylamino)acetamide is sourced from PubChem (CID 112800999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).