2-[1-(2-aminoethyl)naphthalen-2-yl]oxy-N-ethylpropanamide

C17H22N2O2 — CID 60906013

IUPAC2-[1-(2-aminoethyl)naphthalen-2-yl]oxy-N-ethylpropanamide
SMILESCCNC(=O)C(C)Oc1ccc2ccccc2c1CCN
InChIInChI=1S/C17H22N2O2/c1-3-19-17(20)12(2)21-16-9-8-13-6-4-5-7-14(13)15(16)10-11-18/h4-9,12H,3,10-11,18H2,1-2H3,(H,19,20)
InChIKeyPIIWPRFKAUQPSG-UHFFFAOYSA-N
MW286.38 g/mol
LogP2.24
Rot. Bonds6

About 2-[1-(2-aminoethyl)naphthalen-2-yl]oxy-N-ethylpropanamide

2-[1-(2-aminoethyl)naphthalen-2-yl]oxy-N-ethylpropanamide (PubChem CID 60906013) has the molecular formula C17H22N2O2 and a molecular weight of 286.38 g/mol. Its IUPAC name is 2-[1-(2-aminoethyl)naphthalen-2-yl]oxy-N-ethylpropanamide.

Molecular Properties

Compound Name2-[1-(2-aminoethyl)naphthalen-2-yl]oxy-N-ethylpropanamide
PubChem CID60906013
Molecular FormulaC17H22N2O2
Molecular Weight286.38 g/mol
Exact Mass286.17
IUPAC Name2-[1-(2-aminoethyl)naphthalen-2-yl]oxy-N-ethylpropanamide
SMILESCCNC(=O)C(C)Oc1ccc2ccccc2c1CCN
InChIInChI=1S/C17H22N2O2/c1-3-19-17(20)12(2)21-16-9-8-13-6-4-5-7-14(13)15(16)10-11-18/h4-9,12H,3,10-11,18H2,1-2H3,(H,19,20)
InChIKeyPIIWPRFKAUQPSG-UHFFFAOYSA-N
XLogP2.24
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(2-aminoethyl)-3-chlorophenoxy]-N-ethylpropanamide
CID 113277086
2-[1-(2-aminoethyl)naphthalen-2-yl]oxybutanoic acid
CID 64663403
N-ethyl-2-(2-hydroxyphenoxy)propanamide
CID 43143422
2-[[2-(2-aminoethyl)-6-methyl-3-pyridinyl]oxy]-N-ethylpropanamide
CID 79169410
2-[2-(2-aminoethyl)-6-chlorophenoxy]-N-ethylpropanamide
CID 112615083
3-[1-(ethylamino)-1-oxopropan-2-yl]oxynaphthalene-2-carboxylic acid
CID 43089456
(2R)-N-ethyl-2-(2-propan-2-ylphenoxy)propanamide
CID 92685149
N-ethyl-2-[2-[(1R)-1-hydroxyethyl]phenoxy]propanamide
CID 55189875
2-[4-(2-aminoethyl)-2-(trifluoromethyl)phenoxy]-N-ethylpropanamide
CID 63320637
2-[2-(2-aminopropyl)phenoxy]-N-ethylpropanamide
CID 54930401
N-ethyl-2-phenoxypropanamide
CID 4282518
2-[2-(3-methylbut-2-enoxy)naphthalen-1-yl]ethanamine
CID 54930367

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-aminoethyl)naphthalen-2-yl]oxy-N-ethylpropanamide?
The IUPAC name of 2-[1-(2-aminoethyl)naphthalen-2-yl]oxy-N-ethylpropanamide (CID 60906013) is 2-[1-(2-aminoethyl)naphthalen-2-yl]oxy-N-ethylpropanamide.
What is the SMILES notation for 2-[1-(2-aminoethyl)naphthalen-2-yl]oxy-N-ethylpropanamide?
The canonical SMILES for 2-[1-(2-aminoethyl)naphthalen-2-yl]oxy-N-ethylpropanamide is CCNC(=O)C(C)Oc1ccc2ccccc2c1CCN.
What is the InChIKey of 2-[1-(2-aminoethyl)naphthalen-2-yl]oxy-N-ethylpropanamide?
The InChIKey is PIIWPRFKAUQPSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O2/c1-3-19-17(20)12(2)21-16-9-8-13-6-4-5-7-14(13)15(16)10-11-18/h4-9,12H,3,10-11,18H2,1-2H3,(H,19,20).
What are the key properties of 2-[1-(2-aminoethyl)naphthalen-2-yl]oxy-N-ethylpropanamide?
2-[1-(2-aminoethyl)naphthalen-2-yl]oxy-N-ethylpropanamide has a molecular weight of 286.38 g/mol, XLogP of 2.24, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-aminoethyl)naphthalen-2-yl]oxy-N-ethylpropanamide is sourced from PubChem (CID 60906013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).