N-(3,4-dimethoxyphenyl)-2-(naphthalen-1-ylamino)acetamide

C20H20N2O3 — CID 9082418

IUPACN-(3,4-dimethoxyphenyl)-2-(naphthalen-1-ylamino)acetamide
SMILESCOc1ccc(NC(=O)CNc2cccc3ccccc23)cc1OC
InChIInChI=1S/C20H20N2O3/c1-24-18-11-10-15(12-19(18)25-2)22-20(23)13-21-17-9-5-7-14-6-3-4-8-16(14)17/h3-12,21H,13H2,1-2H3,(H,22,23)
InChIKeyPAQHKTQPPHZNOG-UHFFFAOYSA-N
MW336.39 g/mol
LogP3.91
Rot. Bonds6

About N-(3,4-dimethoxyphenyl)-2-(naphthalen-1-ylamino)acetamide

N-(3,4-dimethoxyphenyl)-2-(naphthalen-1-ylamino)acetamide (PubChem CID 9082418) has the molecular formula C20H20N2O3 and a molecular weight of 336.39 g/mol. Its IUPAC name is N-(3,4-dimethoxyphenyl)-2-(naphthalen-1-ylamino)acetamide.

Molecular Properties

Compound NameN-(3,4-dimethoxyphenyl)-2-(naphthalen-1-ylamino)acetamide
PubChem CID9082418
Molecular FormulaC20H20N2O3
Molecular Weight336.39 g/mol
Exact Mass336.15
IUPAC NameN-(3,4-dimethoxyphenyl)-2-(naphthalen-1-ylamino)acetamide
SMILESCOc1ccc(NC(=O)CNc2cccc3ccccc23)cc1OC
InChIInChI=1S/C20H20N2O3/c1-24-18-11-10-15(12-19(18)25-2)22-20(23)13-21-17-9-5-7-14-6-3-4-8-16(14)17/h3-12,21H,13H2,1-2H3,(H,22,23)
InChIKeyPAQHKTQPPHZNOG-UHFFFAOYSA-N
XLogP3.91
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.39
LogP ≤ 53.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-tert-butyl-2-methoxyphenyl)-2-(naphthalen-1-ylamino)acetamide
CID 2456629
2-(4,5-dimethoxy-2-methylanilino)-N-(3,4-dimethoxyphenyl)acetamide
CID 9105356
N-benzyl-2-[[2-(3,4-dimethoxyanilino)-2-oxoethyl]amino]benzamide
CID 2532138
2-(naphthalen-1-ylamino)-N-phenylacetamide
CID 9082358
N-(3,4-dimethoxyphenyl)-2-(2,4-dimethylanilino)acetamide
CID 9081068
4-[[2-(naphthalen-1-ylamino)acetyl]amino]benzamide
CID 46633439
N-(2-bromophenyl)-2-(3,4-dimethoxyanilino)acetamide
CID 109009599
2-(3-bromoanilino)-N-(3,4-dimethoxyphenyl)acetamide
CID 9080374
N-(3-acetylphenyl)-2-(3,4-dimethoxyanilino)acetamide
CID 109009580
N-(3,4-dimethoxyphenyl)-2-[2-ethoxy-3-(4-methylphenyl)sulfonylanilino]acetamide
CID 22304331
[2-(3,4-dimethoxyanilino)-2-oxoethyl] 2-naphthalen-1-ylacetate
CID 2625312
3-[[2-(naphthalen-1-ylamino)acetyl]amino]-N-propan-2-ylbenzamide
CID 54809027

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethoxyphenyl)-2-(naphthalen-1-ylamino)acetamide?
The IUPAC name of N-(3,4-dimethoxyphenyl)-2-(naphthalen-1-ylamino)acetamide (CID 9082418) is N-(3,4-dimethoxyphenyl)-2-(naphthalen-1-ylamino)acetamide.
What is the SMILES notation for N-(3,4-dimethoxyphenyl)-2-(naphthalen-1-ylamino)acetamide?
The canonical SMILES for N-(3,4-dimethoxyphenyl)-2-(naphthalen-1-ylamino)acetamide is COc1ccc(NC(=O)CNc2cccc3ccccc23)cc1OC.
What is the InChIKey of N-(3,4-dimethoxyphenyl)-2-(naphthalen-1-ylamino)acetamide?
The InChIKey is PAQHKTQPPHZNOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O3/c1-24-18-11-10-15(12-19(18)25-2)22-20(23)13-21-17-9-5-7-14-6-3-4-8-16(14)17/h3-12,21H,13H2,1-2H3,(H,22,23).
What are the key properties of N-(3,4-dimethoxyphenyl)-2-(naphthalen-1-ylamino)acetamide?
N-(3,4-dimethoxyphenyl)-2-(naphthalen-1-ylamino)acetamide has a molecular weight of 336.39 g/mol, XLogP of 3.91, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethoxyphenyl)-2-(naphthalen-1-ylamino)acetamide is sourced from PubChem (CID 9082418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).