N-[1-[6-(3-ethoxyphenoxy)naphthalen-2-yl]ethyl]acetamide

C22H23NO3 — CID 68759728

IUPACN-[1-[6-(3-ethoxyphenoxy)naphthalen-2-yl]ethyl]acetamide
SMILESCCOc1cccc(Oc2ccc3cc(C(C)NC(C)=O)ccc3c2)c1
InChIInChI=1S/C22H23NO3/c1-4-25-20-6-5-7-21(14-20)26-22-11-10-18-12-17(8-9-19(18)13-22)15(2)23-16(3)24/h5-15H,4H2,1-3H3,(H,23,24)
InChIKeyHWBHXLSIZYXPCE-UHFFFAOYSA-N
MW349.43 g/mol
LogP5.23
Rot. Bonds6

About N-[1-[6-(3-ethoxyphenoxy)naphthalen-2-yl]ethyl]acetamide

N-[1-[6-(3-ethoxyphenoxy)naphthalen-2-yl]ethyl]acetamide (PubChem CID 68759728) has the molecular formula C22H23NO3 and a molecular weight of 349.43 g/mol. Its IUPAC name is N-[1-[6-(3-ethoxyphenoxy)naphthalen-2-yl]ethyl]acetamide.

Molecular Properties

Compound NameN-[1-[6-(3-ethoxyphenoxy)naphthalen-2-yl]ethyl]acetamide
PubChem CID68759728
Molecular FormulaC22H23NO3
Molecular Weight349.43 g/mol
Exact Mass349.17
IUPAC NameN-[1-[6-(3-ethoxyphenoxy)naphthalen-2-yl]ethyl]acetamide
SMILESCCOc1cccc(Oc2ccc3cc(C(C)NC(C)=O)ccc3c2)c1
InChIInChI=1S/C22H23NO3/c1-4-25-20-6-5-7-21(14-20)26-22-11-10-18-12-17(8-9-19(18)13-22)15(2)23-16(3)24/h5-15H,4H2,1-3H3,(H,23,24)
InChIKeyHWBHXLSIZYXPCE-UHFFFAOYSA-N
XLogP5.23
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500349.43
LogP ≤ 55.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-[6-(3-methoxyphenoxy)naphthalen-2-yl]ethyl]acetamide
CID 68761728
N-[1-[2-(2-bromo-4-ethoxyphenoxy)quinolin-6-yl]ethyl]acetamide
CID 68761187
2-acetamido-N-[1-(3-ethoxyphenyl)ethyl]acetamide
CID 75418201
N-[1-[4-[1-(3-ethoxyphenyl)azetidin-3-yl]oxyphenyl]ethyl]acetamide
CID 123555174
1-[3-(3-ethoxyphenoxy)phenyl]-N-methylethanamine
CID 79167201
N-[1-[2-[4-[3-(cyclopropylmethoxy)phenoxy]phenyl]indazol-5-yl]ethyl]acetamide
CID 130472859
3-ethoxy-N-[(1R)-1-(4-methoxyphenyl)ethyl]benzamide
CID 1252585
N-[1-[2-(3-bromo-4-ethoxyphenoxy)quinolin-6-yl]ethyl]acetamide
CID 68760152
N-[(1R)-1-(3-ethoxyphenyl)ethyl]-2,2-dimethylpropanamide
CID 94813101
N-[1-[2-[5-[3-(2-methoxyethoxy)phenoxy]-2-pyridinyl]-1,3-benzoxazol-6-yl]ethyl]acetamide
CID 130472858
(2S)-N-[(1S)-1-(3-ethoxyphenyl)ethyl]-2-(methylamino)propanamide
CID 125458965
3-[1-(3-ethoxyphenyl)ethyl]-1,1-diethylurea
CID 60600590

Frequently Asked Questions

What is the IUPAC name of N-[1-[6-(3-ethoxyphenoxy)naphthalen-2-yl]ethyl]acetamide?
The IUPAC name of N-[1-[6-(3-ethoxyphenoxy)naphthalen-2-yl]ethyl]acetamide (CID 68759728) is N-[1-[6-(3-ethoxyphenoxy)naphthalen-2-yl]ethyl]acetamide.
What is the SMILES notation for N-[1-[6-(3-ethoxyphenoxy)naphthalen-2-yl]ethyl]acetamide?
The canonical SMILES for N-[1-[6-(3-ethoxyphenoxy)naphthalen-2-yl]ethyl]acetamide is CCOc1cccc(Oc2ccc3cc(C(C)NC(C)=O)ccc3c2)c1.
What is the InChIKey of N-[1-[6-(3-ethoxyphenoxy)naphthalen-2-yl]ethyl]acetamide?
The InChIKey is HWBHXLSIZYXPCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23NO3/c1-4-25-20-6-5-7-21(14-20)26-22-11-10-18-12-17(8-9-19(18)13-22)15(2)23-16(3)24/h5-15H,4H2,1-3H3,(H,23,24).
What are the key properties of N-[1-[6-(3-ethoxyphenoxy)naphthalen-2-yl]ethyl]acetamide?
N-[1-[6-(3-ethoxyphenoxy)naphthalen-2-yl]ethyl]acetamide has a molecular weight of 349.43 g/mol, XLogP of 5.23, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[6-(3-ethoxyphenoxy)naphthalen-2-yl]ethyl]acetamide is sourced from PubChem (CID 68759728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).