N-[2-[7-methoxy-8-(3-methoxyphenyl)naphthalen-1-yl]ethyl]acetamide

C22H23NO3 — CID 22133292

IUPACN-[2-[7-methoxy-8-(3-methoxyphenyl)naphthalen-1-yl]ethyl]acetamide
SMILESCOc1cccc(-c2c(OC)ccc3cccc(CCNC(C)=O)c23)c1
InChIInChI=1S/C22H23NO3/c1-15(24)23-13-12-17-7-4-6-16-10-11-20(26-3)22(21(16)17)18-8-5-9-19(14-18)25-2/h4-11,14H,12-13H2,1-3H3,(H,23,24)
InChIKeyWLGUVPIVHPIQPR-UHFFFAOYSA-N
MW349.43 g/mol
LogP4.20
Rot. Bonds6

About N-[2-[7-methoxy-8-(3-methoxyphenyl)naphthalen-1-yl]ethyl]acetamide

N-[2-[7-methoxy-8-(3-methoxyphenyl)naphthalen-1-yl]ethyl]acetamide (PubChem CID 22133292) has the molecular formula C22H23NO3 and a molecular weight of 349.43 g/mol. Its IUPAC name is N-[2-[7-methoxy-8-(3-methoxyphenyl)naphthalen-1-yl]ethyl]acetamide.

Molecular Properties

Compound NameN-[2-[7-methoxy-8-(3-methoxyphenyl)naphthalen-1-yl]ethyl]acetamide
PubChem CID22133292
Molecular FormulaC22H23NO3
Molecular Weight349.43 g/mol
Exact Mass349.17
IUPAC NameN-[2-[7-methoxy-8-(3-methoxyphenyl)naphthalen-1-yl]ethyl]acetamide
SMILESCOc1cccc(-c2c(OC)ccc3cccc(CCNC(C)=O)c23)c1
InChIInChI=1S/C22H23NO3/c1-15(24)23-13-12-17-7-4-6-16-10-11-20(26-3)22(21(16)17)18-8-5-9-19(14-18)25-2/h4-11,14H,12-13H2,1-3H3,(H,23,24)
InChIKeyWLGUVPIVHPIQPR-UHFFFAOYSA-N
XLogP4.20
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.43
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(8-ethyl-7-methoxynaphthalen-1-yl)ethyl]acetamide
CID 22912546
N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide
CID 139057200
methanol;N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide
CID 174597749
N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide;sulfuric acid
CID 71529133
N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide;propanedioic acid
CID 71477284
N-[3-(7-methoxynaphthalen-1-yl)propyl]acetamide
CID 10220759
N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide;(2S)-2-(6-methoxynaphthalen-2-yl)propanoic acid
CID 71521838
N-[2-[4-[2-(3-methoxyphenyl)-1,3-thiazol-4-yl]phenyl]ethyl]acetamide
CID 9344065
N-[2-[7-methoxy-3-[3-(methylamino)phenyl]naphthalen-1-yl]ethyl]acetamide
CID 44579115
N-[2-(5-acetamido-2-methoxyphenyl)ethyl]-3-methoxybenzamide
CID 110790375
N-[2-(2-fluoro-5-methoxyphenyl)ethyl]acetamide
CID 86035442
N-[2-(2-bromo-5-methoxyphenyl)ethyl]acetamide
CID 12626088

Frequently Asked Questions

What is the IUPAC name of N-[2-[7-methoxy-8-(3-methoxyphenyl)naphthalen-1-yl]ethyl]acetamide?
The IUPAC name of N-[2-[7-methoxy-8-(3-methoxyphenyl)naphthalen-1-yl]ethyl]acetamide (CID 22133292) is N-[2-[7-methoxy-8-(3-methoxyphenyl)naphthalen-1-yl]ethyl]acetamide.
What is the SMILES notation for N-[2-[7-methoxy-8-(3-methoxyphenyl)naphthalen-1-yl]ethyl]acetamide?
The canonical SMILES for N-[2-[7-methoxy-8-(3-methoxyphenyl)naphthalen-1-yl]ethyl]acetamide is COc1cccc(-c2c(OC)ccc3cccc(CCNC(C)=O)c23)c1.
What is the InChIKey of N-[2-[7-methoxy-8-(3-methoxyphenyl)naphthalen-1-yl]ethyl]acetamide?
The InChIKey is WLGUVPIVHPIQPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23NO3/c1-15(24)23-13-12-17-7-4-6-16-10-11-20(26-3)22(21(16)17)18-8-5-9-19(14-18)25-2/h4-11,14H,12-13H2,1-3H3,(H,23,24).
What are the key properties of N-[2-[7-methoxy-8-(3-methoxyphenyl)naphthalen-1-yl]ethyl]acetamide?
N-[2-[7-methoxy-8-(3-methoxyphenyl)naphthalen-1-yl]ethyl]acetamide has a molecular weight of 349.43 g/mol, XLogP of 4.20, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[7-methoxy-8-(3-methoxyphenyl)naphthalen-1-yl]ethyl]acetamide is sourced from PubChem (CID 22133292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).