N,N-diethyl-2-(7-methoxynaphthalen-1-yl)ethanamine

C17H23NO — CID 170604527

IUPACN,N-diethyl-2-(7-methoxynaphthalen-1-yl)ethanamine
SMILESCCN(CC)CCc1cccc2ccc(OC)cc12
InChIInChI=1S/C17H23NO/c1-4-18(5-2)12-11-15-8-6-7-14-9-10-16(19-3)13-17(14)15/h6-10,13H,4-5,11-12H2,1-3H3
InChIKeyHPXUJSGDNOFKIJ-UHFFFAOYSA-N
MW257.38 g/mol
LogP3.73
Rot. Bonds6

About N,N-diethyl-2-(7-methoxynaphthalen-1-yl)ethanamine

N,N-diethyl-2-(7-methoxynaphthalen-1-yl)ethanamine (PubChem CID 170604527) has the molecular formula C17H23NO and a molecular weight of 257.38 g/mol. Its IUPAC name is N,N-diethyl-2-(7-methoxynaphthalen-1-yl)ethanamine.

Molecular Properties

Compound NameN,N-diethyl-2-(7-methoxynaphthalen-1-yl)ethanamine
PubChem CID170604527
Molecular FormulaC17H23NO
Molecular Weight257.38 g/mol
Exact Mass257.18
IUPAC NameN,N-diethyl-2-(7-methoxynaphthalen-1-yl)ethanamine
SMILESCCN(CC)CCc1cccc2ccc(OC)cc12
InChIInChI=1S/C17H23NO/c1-4-18(5-2)12-11-15-8-6-7-14-9-10-16(19-3)13-17(14)15/h6-10,13H,4-5,11-12H2,1-3H3
InChIKeyHPXUJSGDNOFKIJ-UHFFFAOYSA-N
XLogP3.73
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.38
LogP ≤ 53.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-bis[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide
CID 68534392
2-(7-methoxynaphthalen-1-yl)-N-methylethanamine
CID 10104723
N,N-diethyl-2-(3-methoxyphenyl)ethanamine
CID 69380986
N-acetyl-2-amino-N-[2-(7-methoxynaphthalen-1-yl)ethyl]propanamide
CID 71227732
N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide
CID 139057200
5-(7-methoxynaphthalen-1-yl)pentanamide
CID 67627444
N-butylsulfonyl-N-[2-(7-methoxynaphthalen-1-yl)ethyl]hexanamide
CID 71227721
N-(tert-butylsulfamoyl)-N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide
CID 71227478
methanol;N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide
CID 174597749
ethenoxymethanol;N-[2-(7-methoxynaphthalen-1-yl)ethyl]-N-methylacetamide
CID 177154324
1-ethyl-7-(trideuteriomethoxy)naphthalene
CID 59140735
1-(3-bromopropyl)-6-methoxynaphthalene
CID 11514645

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-(7-methoxynaphthalen-1-yl)ethanamine?
The IUPAC name of N,N-diethyl-2-(7-methoxynaphthalen-1-yl)ethanamine (CID 170604527) is N,N-diethyl-2-(7-methoxynaphthalen-1-yl)ethanamine.
What is the SMILES notation for N,N-diethyl-2-(7-methoxynaphthalen-1-yl)ethanamine?
The canonical SMILES for N,N-diethyl-2-(7-methoxynaphthalen-1-yl)ethanamine is CCN(CC)CCc1cccc2ccc(OC)cc12.
What is the InChIKey of N,N-diethyl-2-(7-methoxynaphthalen-1-yl)ethanamine?
The InChIKey is HPXUJSGDNOFKIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23NO/c1-4-18(5-2)12-11-15-8-6-7-14-9-10-16(19-3)13-17(14)15/h6-10,13H,4-5,11-12H2,1-3H3.
What are the key properties of N,N-diethyl-2-(7-methoxynaphthalen-1-yl)ethanamine?
N,N-diethyl-2-(7-methoxynaphthalen-1-yl)ethanamine has a molecular weight of 257.38 g/mol, XLogP of 3.73, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-(7-methoxynaphthalen-1-yl)ethanamine is sourced from PubChem (CID 170604527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).