2-[(2-methoxyphenyl)methyl-methylamino]-N-naphthalen-1-ylacetamide

C21H22N2O2 — CID 2548868

IUPAC2-[(2-methoxyphenyl)methyl-methylamino]-N-naphthalen-1-ylacetamide
SMILESCOc1ccccc1CN(C)CC(=O)Nc1cccc2ccccc12
InChIInChI=1S/C21H22N2O2/c1-23(14-17-9-4-6-13-20(17)25-2)15-21(24)22-19-12-7-10-16-8-3-5-11-18(16)19/h3-13H,14-15H2,1-2H3,(H,22,24)
InChIKeyXDXPCXCXSNMAHX-UHFFFAOYSA-N
MW334.42 g/mol
LogP3.92
Rot. Bonds6

About 2-[(2-methoxyphenyl)methyl-methylamino]-N-naphthalen-1-ylacetamide

2-[(2-methoxyphenyl)methyl-methylamino]-N-naphthalen-1-ylacetamide (PubChem CID 2548868) has the molecular formula C21H22N2O2 and a molecular weight of 334.42 g/mol. Its IUPAC name is 2-[(2-methoxyphenyl)methyl-methylamino]-N-naphthalen-1-ylacetamide.

Molecular Properties

Compound Name2-[(2-methoxyphenyl)methyl-methylamino]-N-naphthalen-1-ylacetamide
PubChem CID2548868
Molecular FormulaC21H22N2O2
Molecular Weight334.42 g/mol
Exact Mass334.17
IUPAC Name2-[(2-methoxyphenyl)methyl-methylamino]-N-naphthalen-1-ylacetamide
SMILESCOc1ccccc1CN(C)CC(=O)Nc1cccc2ccccc12
InChIInChI=1S/C21H22N2O2/c1-23(14-17-9-4-6-13-20(17)25-2)15-21(24)22-19-12-7-10-16-8-3-5-11-18(16)19/h3-13H,14-15H2,1-2H3,(H,22,24)
InChIKeyXDXPCXCXSNMAHX-UHFFFAOYSA-N
XLogP3.92
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-methoxyphenyl)-2,3-dihydro-1H-perimidine
CID 727037
N-[2-(3-methoxy-N-naphthalen-2-ylanilino)ethyl]acetamide
CID 24750189
N-[2-(3-(3-Methylaminophenyl)-7-methoxynaphth-1-yl)ethyl]acetamide
CID 44579115
N-[2-(3-(3-Dimethylaminophenyl)-7-methoxynaphth-1-yl)ethyl]acetamide
CID 44579163
N-(2-ethylphenyl)-2-[(2-hydroxynaphthalen-1-yl)methyl-methylamino]acetamide
CID 2496326
N-(4-methoxyphenyl)-2-[4-(2-methylphenyl)piperazin-1-yl]acetamide
CID 3155501
2-(3,4-dihydro-2(1H)-isoquinolinyl)-N-(4-ethoxyphenyl)acetamide
CID 6466377
N-(2-methoxyphenyl)-2-[methyl-[2-(naphthalen-1-ylamino)-2-oxoethyl]amino]propanamide;hydrochloride
CID 16247486
2-[(4-methoxyphenyl)methyl-methylamino]-N-naphthalen-1-ylpropanamide
CID 16318694
N-(naphthalen-1-yl)-2-(2-oxo-1,3-benzoxazol-3(2H)-yl)acetamide
CID 709694
N-[4-(4-methylpiperazin-1-yl)phenyl]-2-naphthalen-1-yloxyacetamide
CID 1086060
N-(5-Methoxy-1,2,3,4-tetrahydro-naphthalen-1-yl)-3-(4-phenyl-piperazin-1-yl)-propionamide
CID 10500792

Frequently Asked Questions

What is the IUPAC name of 2-[(2-methoxyphenyl)methyl-methylamino]-N-naphthalen-1-ylacetamide?
The IUPAC name of 2-[(2-methoxyphenyl)methyl-methylamino]-N-naphthalen-1-ylacetamide (CID 2548868) is 2-[(2-methoxyphenyl)methyl-methylamino]-N-naphthalen-1-ylacetamide.
What is the SMILES notation for 2-[(2-methoxyphenyl)methyl-methylamino]-N-naphthalen-1-ylacetamide?
The canonical SMILES for 2-[(2-methoxyphenyl)methyl-methylamino]-N-naphthalen-1-ylacetamide is COc1ccccc1CN(C)CC(=O)Nc1cccc2ccccc12.
What is the InChIKey of 2-[(2-methoxyphenyl)methyl-methylamino]-N-naphthalen-1-ylacetamide?
The InChIKey is XDXPCXCXSNMAHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22N2O2/c1-23(14-17-9-4-6-13-20(17)25-2)15-21(24)22-19-12-7-10-16-8-3-5-11-18(16)19/h3-13H,14-15H2,1-2H3,(H,22,24).
What are the key properties of 2-[(2-methoxyphenyl)methyl-methylamino]-N-naphthalen-1-ylacetamide?
2-[(2-methoxyphenyl)methyl-methylamino]-N-naphthalen-1-ylacetamide has a molecular weight of 334.42 g/mol, XLogP of 3.92, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methoxyphenyl)methyl-methylamino]-N-naphthalen-1-ylacetamide is sourced from PubChem (CID 2548868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).