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

C17H21NO2 — CID 10061753

IUPACN-[2-(7-propoxynaphthalen-1-yl)ethyl]acetamide
SMILESCCCOc1ccc2cccc(CCNC(C)=O)c2c1
InChIInChI=1S/C17H21NO2/c1-3-11-20-16-8-7-14-5-4-6-15(17(14)12-16)9-10-18-13(2)19/h4-8,12H,3,9-11H2,1-2H3,(H,18,19)
InChIKeyXEEROKANTVUOFO-UHFFFAOYSA-N
MW271.36 g/mol
LogP3.31
Rot. Bonds6

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

N-[2-(7-propoxynaphthalen-1-yl)ethyl]acetamide (PubChem CID 10061753) has the molecular formula C17H21NO2 and a molecular weight of 271.36 g/mol. Its IUPAC name is N-[2-(7-propoxynaphthalen-1-yl)ethyl]acetamide.

Molecular Properties

Compound NameN-[2-(7-propoxynaphthalen-1-yl)ethyl]acetamide
PubChem CID10061753
Molecular FormulaC17H21NO2
Molecular Weight271.36 g/mol
Exact Mass271.16
IUPAC NameN-[2-(7-propoxynaphthalen-1-yl)ethyl]acetamide
SMILESCCCOc1ccc2cccc(CCNC(C)=O)c2c1
InChIInChI=1S/C17H21NO2/c1-3-11-20-16-8-7-14-5-4-6-15(17(14)12-16)9-10-18-13(2)19/h4-8,12H,3,9-11H2,1-2H3,(H,18,19)
InChIKeyXEEROKANTVUOFO-UHFFFAOYSA-N
XLogP3.31
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-[7-(4-naphthalen-2-yloxybutoxy)naphthalen-1-yl]ethyl]acetamide
CID 90888260
N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide
CID 139057200
methanol;N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide
CID 174597749
N-[2-[7-[4-[[3-(2-acetamidoethyl)-1H-indol-5-yl]oxy]butoxy]naphthalen-1-yl]ethyl]acetamide
CID 46888491
N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide;sulfuric acid
CID 71529133
N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide;propanedioic acid
CID 71477284
2-[8-[2-(butanoylamino)ethyl]naphthalen-2-yl]oxyacetic acid
CID 18783026
N-[3-(7-methoxynaphthalen-1-yl)propyl]acetamide
CID 10220759
N-[2-(3-benzyl-7-pentoxynaphthalen-1-yl)ethyl]acetamide
CID 23360915
2-[8-[2-(propanoylamino)ethyl]naphthalen-2-yl]oxyacetic acid
CID 18783000
N-[2-(7-hexylnaphthalen-1-yl)ethyl]acetamide
CID 140972151
2-(7-butoxynaphthalen-1-yl)acetic acid
CID 19085996

Frequently Asked Questions

What is the IUPAC name of N-[2-(7-propoxynaphthalen-1-yl)ethyl]acetamide?
The IUPAC name of N-[2-(7-propoxynaphthalen-1-yl)ethyl]acetamide (CID 10061753) is N-[2-(7-propoxynaphthalen-1-yl)ethyl]acetamide.
What is the SMILES notation for N-[2-(7-propoxynaphthalen-1-yl)ethyl]acetamide?
The canonical SMILES for N-[2-(7-propoxynaphthalen-1-yl)ethyl]acetamide is CCCOc1ccc2cccc(CCNC(C)=O)c2c1.
What is the InChIKey of N-[2-(7-propoxynaphthalen-1-yl)ethyl]acetamide?
The InChIKey is XEEROKANTVUOFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO2/c1-3-11-20-16-8-7-14-5-4-6-15(17(14)12-16)9-10-18-13(2)19/h4-8,12H,3,9-11H2,1-2H3,(H,18,19).
What are the key properties of N-[2-(7-propoxynaphthalen-1-yl)ethyl]acetamide?
N-[2-(7-propoxynaphthalen-1-yl)ethyl]acetamide has a molecular weight of 271.36 g/mol, XLogP of 3.31, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(7-propoxynaphthalen-1-yl)ethyl]acetamide is sourced from PubChem (CID 10061753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).