N-[1-(6-methoxy-3,4-dihydronaphthalen-1-yl)ethenyl]-N-methylacetamide

C16H19NO2 — CID 11054318

IUPACN-[1-(6-methoxy-3,4-dihydronaphthalen-1-yl)ethenyl]-N-methylacetamide
SMILESC=C(C1=CCCc2cc(OC)ccc21)N(C)C(C)=O
InChIInChI=1S/C16H19NO2/c1-11(17(3)12(2)18)15-7-5-6-13-10-14(19-4)8-9-16(13)15/h7-10H,1,5-6H2,2-4H3
InChIKeyCKHIWGCXTIICCP-UHFFFAOYSA-N
MW257.33 g/mol
LogP3.02
Rot. Bonds3

About N-[1-(6-methoxy-3,4-dihydronaphthalen-1-yl)ethenyl]-N-methylacetamide

N-[1-(6-methoxy-3,4-dihydronaphthalen-1-yl)ethenyl]-N-methylacetamide (PubChem CID 11054318) has the molecular formula C16H19NO2 and a molecular weight of 257.33 g/mol. Its IUPAC name is N-[1-(6-methoxy-3,4-dihydronaphthalen-1-yl)ethenyl]-N-methylacetamide.

Molecular Properties

Compound NameN-[1-(6-methoxy-3,4-dihydronaphthalen-1-yl)ethenyl]-N-methylacetamide
PubChem CID11054318
Molecular FormulaC16H19NO2
Molecular Weight257.33 g/mol
Exact Mass257.14
IUPAC NameN-[1-(6-methoxy-3,4-dihydronaphthalen-1-yl)ethenyl]-N-methylacetamide
SMILESC=C(C1=CCCc2cc(OC)ccc21)N(C)C(C)=O
InChIInChI=1S/C16H19NO2/c1-11(17(3)12(2)18)15-7-5-6-13-10-14(19-4)8-9-16(13)15/h7-10H,1,5-6H2,2-4H3
InChIKeyCKHIWGCXTIICCP-UHFFFAOYSA-N
XLogP3.02
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.33
LogP ≤ 53.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(6-methoxy-3,4-dihydronaphthalen-1-yl)-(3,4,5-trimethoxyphenyl)methanone
CID 10043693
6-methoxy-3,4-dihydronaphthalene-1-carbaldehyde
CID 13275745
(6-methoxy-3,4-dihydronaphthalen-1-yl) 2,2,2-trifluoroacetate
CID 14175471
[2-[(Z)-3-hydroxy-1-(6-methoxy-3,4-dihydronaphthalen-1-yl)-3-methylbut-1-enyl]-4-methylphenyl] acetate
CID 10524568
(2E)-2-(5-methoxy-2,3-dihydroinden-1-ylidene)acetamide
CID 10888983
(1S,2R,4R)-1-[[(R)-1-(6-methoxy-3,4-dihydronaphthalen-1-yl)ethenylsulfinyl]methyl]-7,7-dimethylbicyclo[2.2.1]heptan-2-ol
CID 11269194
2-methoxy-5-methyl-8,9-dihydro-7H-benzo[7]annulene
CID 13275751
2-acetyl-5-methoxy-2,3-dihydroinden-1-one
CID 121012834
(7-methoxy-9,10-dihydrophenanthren-2-yl) 6-acetylnaphthalene-2-carboxylate
CID 58800525
6-methoxy-3,4-dihydro-2H-naphthalen-1-one
CID 14112
(7-methoxy-3,4-dihydronaphthalen-1-yl) trifluoromethanesulfonate
CID 11243752
4-[2-(4-fluorophenyl)ethyl]-7-methoxy-1,2-dihydronaphthalene
CID 172732247

Frequently Asked Questions

What is the IUPAC name of N-[1-(6-methoxy-3,4-dihydronaphthalen-1-yl)ethenyl]-N-methylacetamide?
The IUPAC name of N-[1-(6-methoxy-3,4-dihydronaphthalen-1-yl)ethenyl]-N-methylacetamide (CID 11054318) is N-[1-(6-methoxy-3,4-dihydronaphthalen-1-yl)ethenyl]-N-methylacetamide.
What is the SMILES notation for N-[1-(6-methoxy-3,4-dihydronaphthalen-1-yl)ethenyl]-N-methylacetamide?
The canonical SMILES for N-[1-(6-methoxy-3,4-dihydronaphthalen-1-yl)ethenyl]-N-methylacetamide is C=C(C1=CCCc2cc(OC)ccc21)N(C)C(C)=O.
What is the InChIKey of N-[1-(6-methoxy-3,4-dihydronaphthalen-1-yl)ethenyl]-N-methylacetamide?
The InChIKey is CKHIWGCXTIICCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO2/c1-11(17(3)12(2)18)15-7-5-6-13-10-14(19-4)8-9-16(13)15/h7-10H,1,5-6H2,2-4H3.
What are the key properties of N-[1-(6-methoxy-3,4-dihydronaphthalen-1-yl)ethenyl]-N-methylacetamide?
N-[1-(6-methoxy-3,4-dihydronaphthalen-1-yl)ethenyl]-N-methylacetamide has a molecular weight of 257.33 g/mol, XLogP of 3.02, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(6-methoxy-3,4-dihydronaphthalen-1-yl)ethenyl]-N-methylacetamide is sourced from PubChem (CID 11054318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).