N-[6-(dimethylamino)naphthalen-2-yl]-2-(5-oxooxolan-3-yl)acetamide

C18H20N2O3 — CID 126816958

IUPACN-[6-(dimethylamino)naphthalen-2-yl]-2-(5-oxooxolan-3-yl)acetamide
SMILESCN(C)c1ccc2cc(NC(=O)CC3COC(=O)C3)ccc2c1
InChIInChI=1S/C18H20N2O3/c1-20(2)16-6-4-13-9-15(5-3-14(13)10-16)19-17(21)7-12-8-18(22)23-11-12/h3-6,9-10,12H,7-8,11H2,1-2H3,(H,19,21)
InChIKeyFTAJKBSRYOSQOD-UHFFFAOYSA-N
MW312.37 g/mol
LogP2.80
Rot. Bonds4

About N-[6-(dimethylamino)naphthalen-2-yl]-2-(5-oxooxolan-3-yl)acetamide

N-[6-(dimethylamino)naphthalen-2-yl]-2-(5-oxooxolan-3-yl)acetamide (PubChem CID 126816958) has the molecular formula C18H20N2O3 and a molecular weight of 312.37 g/mol. Its IUPAC name is N-[6-(dimethylamino)naphthalen-2-yl]-2-(5-oxooxolan-3-yl)acetamide.

Molecular Properties

Compound NameN-[6-(dimethylamino)naphthalen-2-yl]-2-(5-oxooxolan-3-yl)acetamide
PubChem CID126816958
Molecular FormulaC18H20N2O3
Molecular Weight312.37 g/mol
Exact Mass312.15
IUPAC NameN-[6-(dimethylamino)naphthalen-2-yl]-2-(5-oxooxolan-3-yl)acetamide
SMILESCN(C)c1ccc2cc(NC(=O)CC3COC(=O)C3)ccc2c1
InChIInChI=1S/C18H20N2O3/c1-20(2)16-6-4-13-9-15(5-3-14(13)10-16)19-17(21)7-12-8-18(22)23-11-12/h3-6,9-10,12H,7-8,11H2,1-2H3,(H,19,21)
InChIKeyFTAJKBSRYOSQOD-UHFFFAOYSA-N
XLogP2.80
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 2-hydroxy-5-[[2-[(3R)-5-oxooxolan-3-yl]acetyl]amino]benzoate
CID 125144290
N-[6-(dimethylamino)naphthalen-2-yl]-2-(methylsulfamoyl)acetamide
CID 122153685
2-cyclopentyl-N-[4-(dimethylamino)phenyl]acetamide
CID 47097970
N-(6-bromonaphthalen-2-yl)-2-cyclopropylacetamide
CID 81004000
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[methyl(naphthalen-2-yl)amino]acetamide
CID 8593303
N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[methyl(naphthalen-2-yl)amino]acetamide
CID 8593215
N-(1H-indol-5-yl)-2-(oxetan-3-yl)acetamide
CID 112526005
N-[4-(dimethylamino)phenyl]-2-(oxolan-2-yl)acetamide
CID 110696648
N-(2-methyl-1,3-benzothiazol-6-yl)-2-(oxetan-3-yl)acetamide
CID 112523804
N-[4-(dimethylamino)phenyl]-2-naphthalen-2-ylsulfonylacetamide
CID 3938895
N-[4-(dimethylamino)phenyl]-2-(4-oxo-1,3-thiazolidin-5-yl)acetamide
CID 25105396
2-cyclopropyl-N-(4-methoxyphenyl)acetamide
CID 3008382

Frequently Asked Questions

What is the IUPAC name of N-[6-(dimethylamino)naphthalen-2-yl]-2-(5-oxooxolan-3-yl)acetamide?
The IUPAC name of N-[6-(dimethylamino)naphthalen-2-yl]-2-(5-oxooxolan-3-yl)acetamide (CID 126816958) is N-[6-(dimethylamino)naphthalen-2-yl]-2-(5-oxooxolan-3-yl)acetamide.
What is the SMILES notation for N-[6-(dimethylamino)naphthalen-2-yl]-2-(5-oxooxolan-3-yl)acetamide?
The canonical SMILES for N-[6-(dimethylamino)naphthalen-2-yl]-2-(5-oxooxolan-3-yl)acetamide is CN(C)c1ccc2cc(NC(=O)CC3COC(=O)C3)ccc2c1.
What is the InChIKey of N-[6-(dimethylamino)naphthalen-2-yl]-2-(5-oxooxolan-3-yl)acetamide?
The InChIKey is FTAJKBSRYOSQOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O3/c1-20(2)16-6-4-13-9-15(5-3-14(13)10-16)19-17(21)7-12-8-18(22)23-11-12/h3-6,9-10,12H,7-8,11H2,1-2H3,(H,19,21).
What are the key properties of N-[6-(dimethylamino)naphthalen-2-yl]-2-(5-oxooxolan-3-yl)acetamide?
N-[6-(dimethylamino)naphthalen-2-yl]-2-(5-oxooxolan-3-yl)acetamide has a molecular weight of 312.37 g/mol, XLogP of 2.80, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(dimethylamino)naphthalen-2-yl]-2-(5-oxooxolan-3-yl)acetamide is sourced from PubChem (CID 126816958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).