N-[2-[(2,4-dimethoxyphenyl)methyl-methylamino]-2-oxoethyl]naphthalene-2-carboxamide

C23H24N2O4 — CID 4792186

IUPACN-[2-[(2,4-dimethoxyphenyl)methyl-methylamino]-2-oxoethyl]naphthalene-2-carboxamide
SMILESCOc1ccc(CN(C)C(=O)CNC(=O)c2ccc3ccccc3c2)c(OC)c1
InChIInChI=1S/C23H24N2O4/c1-25(15-19-10-11-20(28-2)13-21(19)29-3)22(26)14-24-23(27)18-9-8-16-6-4-5-7-17(16)12-18/h4-13H,14-15H2,1-3H3,(H,24,27)
InChIKeySRFBZBAXEYTQMZ-UHFFFAOYSA-N
MW392.46 g/mol
LogP3.25
Rot. Bonds7

About N-[2-[(2,4-dimethoxyphenyl)methyl-methylamino]-2-oxoethyl]naphthalene-2-carboxamide

N-[2-[(2,4-dimethoxyphenyl)methyl-methylamino]-2-oxoethyl]naphthalene-2-carboxamide (PubChem CID 4792186) has the molecular formula C23H24N2O4 and a molecular weight of 392.46 g/mol. Its IUPAC name is N-[2-[(2,4-dimethoxyphenyl)methyl-methylamino]-2-oxoethyl]naphthalene-2-carboxamide.

Molecular Properties

Compound NameN-[2-[(2,4-dimethoxyphenyl)methyl-methylamino]-2-oxoethyl]naphthalene-2-carboxamide
PubChem CID4792186
Molecular FormulaC23H24N2O4
Molecular Weight392.46 g/mol
Exact Mass392.17
IUPAC NameN-[2-[(2,4-dimethoxyphenyl)methyl-methylamino]-2-oxoethyl]naphthalene-2-carboxamide
SMILESCOc1ccc(CN(C)C(=O)CNC(=O)c2ccc3ccccc3c2)c(OC)c1
InChIInChI=1S/C23H24N2O4/c1-25(15-19-10-11-20(28-2)13-21(19)29-3)22(26)14-24-23(27)18-9-8-16-6-4-5-7-17(16)12-18/h4-13H,14-15H2,1-3H3,(H,24,27)
InChIKeySRFBZBAXEYTQMZ-UHFFFAOYSA-N
XLogP3.25
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.46
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(E)-3-(2,4-dimethoxyphenyl)-2-(4-fluorophenyl)prop-2-enoyl]-N-hydroxy-3,4-dihydro-1H-isoquinoline-7-carboxamide
CID 71454842
Sicdvfqigzixso-uhfffaoysa-
CID 10759138
N-(2,2-diphenylethyl)-4-methoxy-3,5-dimethyl-N-[2-(methylamino)-2-oxidanylidene-ethyl]benzamide
CID 156009104
N-{[1-(2-methoxybenzyl)piperidin-3-yl]methyl}-1-naphthamide
CID 23723659
3-[(2-Methoxy-benzylamino)-methyl]-2,6,7-trimethyl-4-phenyl-2H-isoquinolin-1-one
CID 10251123
2-Methyl-1-oxo-4-o-tolyl-1,2-dihydro-isoquinoline-3-carboxylic acid 2-methoxy-benzylamide
CID 10386984
2-Methyl-1-oxo-4-phenyl-1,2-dihydro-isoquinoline-3-carboxylic acid 2-methoxy-benzylamide
CID 10408564
[4-(3-Methoxyphenoxy)-3-(methylaminomethyl)phenyl]-(4-propan-2-ylpiperazin-1-yl)methanone
CID 24947752
3,5-dimethoxy-N-(1-(naphthalen-2-ylmethyl)piperidin-4-yl)benzamide
CID 44417828
(R)-3,5-dimethoxy-N-(1-(naphthalen-2-ylmethyl)pyrrolidin-3-yl)benzamide
CID 44417850
7,8-Dimethoxy-4-(3,4,5-trimethoxyphenyl)-1,2-dihydro-3H-benzo[e]isoindol-3-one
CID 4550667
Substituted Benzamide Derivative, 5e
CID 977744

Frequently Asked Questions

What is the IUPAC name of N-[2-[(2,4-dimethoxyphenyl)methyl-methylamino]-2-oxoethyl]naphthalene-2-carboxamide?
The IUPAC name of N-[2-[(2,4-dimethoxyphenyl)methyl-methylamino]-2-oxoethyl]naphthalene-2-carboxamide (CID 4792186) is N-[2-[(2,4-dimethoxyphenyl)methyl-methylamino]-2-oxoethyl]naphthalene-2-carboxamide.
What is the SMILES notation for N-[2-[(2,4-dimethoxyphenyl)methyl-methylamino]-2-oxoethyl]naphthalene-2-carboxamide?
The canonical SMILES for N-[2-[(2,4-dimethoxyphenyl)methyl-methylamino]-2-oxoethyl]naphthalene-2-carboxamide is COc1ccc(CN(C)C(=O)CNC(=O)c2ccc3ccccc3c2)c(OC)c1.
What is the InChIKey of N-[2-[(2,4-dimethoxyphenyl)methyl-methylamino]-2-oxoethyl]naphthalene-2-carboxamide?
The InChIKey is SRFBZBAXEYTQMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O4/c1-25(15-19-10-11-20(28-2)13-21(19)29-3)22(26)14-24-23(27)18-9-8-16-6-4-5-7-17(16)12-18/h4-13H,14-15H2,1-3H3,(H,24,27).
What are the key properties of N-[2-[(2,4-dimethoxyphenyl)methyl-methylamino]-2-oxoethyl]naphthalene-2-carboxamide?
N-[2-[(2,4-dimethoxyphenyl)methyl-methylamino]-2-oxoethyl]naphthalene-2-carboxamide has a molecular weight of 392.46 g/mol, XLogP of 3.25, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(2,4-dimethoxyphenyl)methyl-methylamino]-2-oxoethyl]naphthalene-2-carboxamide is sourced from PubChem (CID 4792186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).