N-[2-[(6-methoxynaphthalen-2-yl)methylamino]-2-oxoethyl]-3,5-dimethylbenzamide

C23H24N2O3 — CID 41255483

IUPACN-[2-[(6-methoxynaphthalen-2-yl)methylamino]-2-oxoethyl]-3,5-dimethylbenzamide
SMILESCOc1ccc2cc(CNC(=O)CNC(=O)c3cc(C)cc(C)c3)ccc2c1
InChIInChI=1S/C23H24N2O3/c1-15-8-16(2)10-20(9-15)23(27)25-14-22(26)24-13-17-4-5-19-12-21(28-3)7-6-18(19)11-17/h4-12H,13-14H2,1-3H3,(H,24,26)(H,25,27)
InChIKeyWIVYASYYGADNMZ-UHFFFAOYSA-N
MW376.46 g/mol
LogP3.51
Rot. Bonds6

About N-[2-[(6-methoxynaphthalen-2-yl)methylamino]-2-oxoethyl]-3,5-dimethylbenzamide

N-[2-[(6-methoxynaphthalen-2-yl)methylamino]-2-oxoethyl]-3,5-dimethylbenzamide (PubChem CID 41255483) has the molecular formula C23H24N2O3 and a molecular weight of 376.46 g/mol. Its IUPAC name is N-[2-[(6-methoxynaphthalen-2-yl)methylamino]-2-oxoethyl]-3,5-dimethylbenzamide.

Molecular Properties

Compound NameN-[2-[(6-methoxynaphthalen-2-yl)methylamino]-2-oxoethyl]-3,5-dimethylbenzamide
PubChem CID41255483
Molecular FormulaC23H24N2O3
Molecular Weight376.46 g/mol
Exact Mass376.18
IUPAC NameN-[2-[(6-methoxynaphthalen-2-yl)methylamino]-2-oxoethyl]-3,5-dimethylbenzamide
SMILESCOc1ccc2cc(CNC(=O)CNC(=O)c3cc(C)cc(C)c3)ccc2c1
InChIInChI=1S/C23H24N2O3/c1-15-8-16(2)10-20(9-15)23(27)25-14-22(26)24-13-17-4-5-19-12-21(28-3)7-6-18(19)11-17/h4-12H,13-14H2,1-3H3,(H,24,26)(H,25,27)
InChIKeyWIVYASYYGADNMZ-UHFFFAOYSA-N
XLogP3.51
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 53.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-[(6-methoxynaphthalen-2-yl)methylamino]-2-oxoethyl]-3,5-dimethylbenzamide?
The IUPAC name of N-[2-[(6-methoxynaphthalen-2-yl)methylamino]-2-oxoethyl]-3,5-dimethylbenzamide (CID 41255483) is N-[2-[(6-methoxynaphthalen-2-yl)methylamino]-2-oxoethyl]-3,5-dimethylbenzamide.
What is the SMILES notation for N-[2-[(6-methoxynaphthalen-2-yl)methylamino]-2-oxoethyl]-3,5-dimethylbenzamide?
The canonical SMILES for N-[2-[(6-methoxynaphthalen-2-yl)methylamino]-2-oxoethyl]-3,5-dimethylbenzamide is COc1ccc2cc(CNC(=O)CNC(=O)c3cc(C)cc(C)c3)ccc2c1.
What is the InChIKey of N-[2-[(6-methoxynaphthalen-2-yl)methylamino]-2-oxoethyl]-3,5-dimethylbenzamide?
The InChIKey is WIVYASYYGADNMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O3/c1-15-8-16(2)10-20(9-15)23(27)25-14-22(26)24-13-17-4-5-19-12-21(28-3)7-6-18(19)11-17/h4-12H,13-14H2,1-3H3,(H,24,26)(H,25,27).
What are the key properties of N-[2-[(6-methoxynaphthalen-2-yl)methylamino]-2-oxoethyl]-3,5-dimethylbenzamide?
N-[2-[(6-methoxynaphthalen-2-yl)methylamino]-2-oxoethyl]-3,5-dimethylbenzamide has a molecular weight of 376.46 g/mol, XLogP of 3.51, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(6-methoxynaphthalen-2-yl)methylamino]-2-oxoethyl]-3,5-dimethylbenzamide is sourced from PubChem (CID 41255483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).