(6-acetamido-3,4-dihydronaphthalen-2-yl) acetate

C14H15NO3 — CID 70154325

IUPAC(6-acetamido-3,4-dihydronaphthalen-2-yl) acetate
SMILESCC(=O)Nc1ccc2c(c1)CCC(OC(C)=O)=C2
InChIInChI=1S/C14H15NO3/c1-9(16)15-13-5-3-12-8-14(18-10(2)17)6-4-11(12)7-13/h3,5,7-8H,4,6H2,1-2H3,(H,15,16)
InChIKeyUEIFYKBZTPVDKY-UHFFFAOYSA-N
MW245.28 g/mol
LogP2.50
Rot. Bonds2

About (6-acetamido-3,4-dihydronaphthalen-2-yl) acetate

(6-acetamido-3,4-dihydronaphthalen-2-yl) acetate (PubChem CID 70154325) has the molecular formula C14H15NO3 and a molecular weight of 245.28 g/mol. Its IUPAC name is (6-acetamido-3,4-dihydronaphthalen-2-yl) acetate.

Molecular Properties

Compound Name(6-acetamido-3,4-dihydronaphthalen-2-yl) acetate
PubChem CID70154325
Molecular FormulaC14H15NO3
Molecular Weight245.28 g/mol
Exact Mass245.11
IUPAC Name(6-acetamido-3,4-dihydronaphthalen-2-yl) acetate
SMILESCC(=O)Nc1ccc2c(c1)CCC(OC(C)=O)=C2
InChIInChI=1S/C14H15NO3/c1-9(16)15-13-5-3-12-8-14(18-10(2)17)6-4-11(12)7-13/h3,5,7-8H,4,6H2,1-2H3,(H,15,16)
InChIKeyUEIFYKBZTPVDKY-UHFFFAOYSA-N
XLogP2.50
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (6-acetamido-3,4-dihydronaphthalen-2-yl) acetate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(1,2,3,4-tetrahydroisoquinolin-2-ium-7-yl)acetamide chloride
CID 10775658
N-(1-acetamido-1-hydroxy-2,3-dihydroinden-5-yl)acetamide
CID 174789952
N-(2',5'-dioxospiro[2,3-dihydroindene-1,4'-imidazolidine]-5-yl)acetamide
CID 118956972
N-(3,5-diacetamidophenyl)acetamide
CID 12731559
N-[7-(aminomethyl)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-3-yl]acetamide
CID 123877752
N-(4-acetyl-3-methylphenyl)acetamide
CID 2737381
N-[(1R)-1-amino-2,3-dihydro-1H-inden-5-yl]acetamide
CID 55277889
N-(1H-isoindol-5-yl)acetamide
CID 142070136
CID 66827885
CID 66827885
tert-butyl N-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)carbamate
CID 134368267
N-(2-propan-2-yl-1,3-dihydroisoindol-5-yl)acetamide
CID 110459252
(3-oxocyclohexen-1-yl) acetate
CID 2755443

Frequently Asked Questions

What is the IUPAC name of (6-acetamido-3,4-dihydronaphthalen-2-yl) acetate?
The IUPAC name of (6-acetamido-3,4-dihydronaphthalen-2-yl) acetate (CID 70154325) is (6-acetamido-3,4-dihydronaphthalen-2-yl) acetate.
What is the SMILES notation for (6-acetamido-3,4-dihydronaphthalen-2-yl) acetate?
The canonical SMILES for (6-acetamido-3,4-dihydronaphthalen-2-yl) acetate is CC(=O)Nc1ccc2c(c1)CCC(OC(C)=O)=C2.
What is the InChIKey of (6-acetamido-3,4-dihydronaphthalen-2-yl) acetate?
The InChIKey is UEIFYKBZTPVDKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO3/c1-9(16)15-13-5-3-12-8-14(18-10(2)17)6-4-11(12)7-13/h3,5,7-8H,4,6H2,1-2H3,(H,15,16).
What are the key properties of (6-acetamido-3,4-dihydronaphthalen-2-yl) acetate?
(6-acetamido-3,4-dihydronaphthalen-2-yl) acetate has a molecular weight of 245.28 g/mol, XLogP of 2.50, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6-acetamido-3,4-dihydronaphthalen-2-yl) acetate is sourced from PubChem (CID 70154325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).