N-[2-(2,7-dimethoxynaphthalen-1-yl)ethyl]acetamide

C16H19NO3 — CID 10265309

IUPACN-[2-(2,7-dimethoxynaphthalen-1-yl)ethyl]acetamide
SMILESCOc1ccc2ccc(OC)c(CCNC(C)=O)c2c1
InChIInChI=1S/C16H19NO3/c1-11(18)17-9-8-14-15-10-13(19-2)6-4-12(15)5-7-16(14)20-3/h4-7,10H,8-9H2,1-3H3,(H,17,18)
InChIKeyGURZWDBOLSYLPG-UHFFFAOYSA-N
MW273.33 g/mol
LogP2.54
Rot. Bonds5

About N-[2-(2,7-dimethoxynaphthalen-1-yl)ethyl]acetamide

N-[2-(2,7-dimethoxynaphthalen-1-yl)ethyl]acetamide (PubChem CID 10265309) has the molecular formula C16H19NO3 and a molecular weight of 273.33 g/mol. Its IUPAC name is N-[2-(2,7-dimethoxynaphthalen-1-yl)ethyl]acetamide.

Molecular Properties

Compound NameN-[2-(2,7-dimethoxynaphthalen-1-yl)ethyl]acetamide
PubChem CID10265309
Molecular FormulaC16H19NO3
Molecular Weight273.33 g/mol
Exact Mass273.14
IUPAC NameN-[2-(2,7-dimethoxynaphthalen-1-yl)ethyl]acetamide
SMILESCOc1ccc2ccc(OC)c(CCNC(C)=O)c2c1
InChIInChI=1S/C16H19NO3/c1-11(18)17-9-8-14-15-10-13(19-2)6-4-12(15)5-7-16(14)20-3/h4-7,10H,8-9H2,1-3H3,(H,17,18)
InChIKeyGURZWDBOLSYLPG-UHFFFAOYSA-N
XLogP2.54
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.33
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Agomelatine
CID 82148
Motretinide
CID 6314185
N-[2-[7-[3-[8-(2-acetamidoethyl)naphthalen-2-yl]oxypropoxy]naphthalen-1-yl]ethyl]acetamide
CID 9870523
Propanamide, N-(2-(7-methoxy-1-naphthalenyl)ethyl)-
CID 3071631
Butanamide, 4-chloro-N-(2-(7-methoxy-1-naphthalenyl)ethyl)-
CID 3071634
2-Pyrrolidinone, 1-(2-(7-methoxy-1-naphthalenyl)ethyl)-
CID 3071635
Acetamide, 2-bromo-N-(2-(7-methoxy-1-naphthalenyl)ethyl)-
CID 3071636
Butanamide, N-(2-(7-methoxy-1-naphthalenyl)ethyl)-
CID 3071652
(Hydroxymethylphenyl)agomelatine
CID 9798456
N-[2-[7-[4-[8-(2-acetamidoethyl)naphthalen-2-yl]oxybutoxy]naphthalen-1-yl]ethyl]acetamide
CID 9806449
N-[(6-Methoxy-9-tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaenyl)methyl]acetamide
CID 11185529
Cifea
CID 53238181

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,7-dimethoxynaphthalen-1-yl)ethyl]acetamide?
The IUPAC name of N-[2-(2,7-dimethoxynaphthalen-1-yl)ethyl]acetamide (CID 10265309) is N-[2-(2,7-dimethoxynaphthalen-1-yl)ethyl]acetamide.
What is the SMILES notation for N-[2-(2,7-dimethoxynaphthalen-1-yl)ethyl]acetamide?
The canonical SMILES for N-[2-(2,7-dimethoxynaphthalen-1-yl)ethyl]acetamide is COc1ccc2ccc(OC)c(CCNC(C)=O)c2c1.
What is the InChIKey of N-[2-(2,7-dimethoxynaphthalen-1-yl)ethyl]acetamide?
The InChIKey is GURZWDBOLSYLPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO3/c1-11(18)17-9-8-14-15-10-13(19-2)6-4-12(15)5-7-16(14)20-3/h4-7,10H,8-9H2,1-3H3,(H,17,18).
What are the key properties of N-[2-(2,7-dimethoxynaphthalen-1-yl)ethyl]acetamide?
N-[2-(2,7-dimethoxynaphthalen-1-yl)ethyl]acetamide has a molecular weight of 273.33 g/mol, XLogP of 2.54, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,7-dimethoxynaphthalen-1-yl)ethyl]acetamide is sourced from PubChem (CID 10265309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).