(2R)-N,N-diethyl-2-naphthalen-1-yloxypropanamide

C17H21NO2 — CID 13013865

IUPAC(2R)-N,N-diethyl-2-naphthalen-1-yloxypropanamide
SMILESCCN(CC)C(=O)[C@@H](C)Oc1cccc2ccccc12
InChIInChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3/t13-/m1/s1
InChIKeyWXZVAROIGSFCFJ-CYBMUJFWSA-N
MW271.36 g/mol
LogP3.48
Rot. Bonds5

About (2R)-N,N-diethyl-2-naphthalen-1-yloxypropanamide

(2R)-N,N-diethyl-2-naphthalen-1-yloxypropanamide (PubChem CID 13013865) has the molecular formula C17H21NO2 and a molecular weight of 271.36 g/mol. Its IUPAC name is (2R)-N,N-diethyl-2-naphthalen-1-yloxypropanamide.

Molecular Properties

Compound Name(2R)-N,N-diethyl-2-naphthalen-1-yloxypropanamide
PubChem CID13013865
Molecular FormulaC17H21NO2
Molecular Weight271.36 g/mol
Exact Mass271.16
IUPAC Name(2R)-N,N-diethyl-2-naphthalen-1-yloxypropanamide
SMILESCCN(CC)C(=O)[C@@H](C)Oc1cccc2ccccc12
InChIInChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3/t13-/m1/s1
InChIKeyWXZVAROIGSFCFJ-CYBMUJFWSA-N
XLogP3.48
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 53.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

CID 27189
CID 27189
CID 39328
CID 39328
CID 200475
CID 200475
CID 98212
CID 98212
CID 2226306
CID 2226306
CID 17650443
CID 17650443
CID 38088
CID 38088
CID 920934
CID 920934
CID 38089
CID 38089
CID 773942
CID 773942
CID 801549
CID 801549
CID 833263
CID 833263

Frequently Asked Questions

What is the IUPAC name of (2R)-N,N-diethyl-2-naphthalen-1-yloxypropanamide?
The IUPAC name of (2R)-N,N-diethyl-2-naphthalen-1-yloxypropanamide (CID 13013865) is (2R)-N,N-diethyl-2-naphthalen-1-yloxypropanamide.
What is the SMILES notation for (2R)-N,N-diethyl-2-naphthalen-1-yloxypropanamide?
The canonical SMILES for (2R)-N,N-diethyl-2-naphthalen-1-yloxypropanamide is CCN(CC)C(=O)[C@@H](C)Oc1cccc2ccccc12.
What is the InChIKey of (2R)-N,N-diethyl-2-naphthalen-1-yloxypropanamide?
The InChIKey is WXZVAROIGSFCFJ-CYBMUJFWSA-N. The full InChI is InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3/t13-/m1/s1.
What are the key properties of (2R)-N,N-diethyl-2-naphthalen-1-yloxypropanamide?
(2R)-N,N-diethyl-2-naphthalen-1-yloxypropanamide has a molecular weight of 271.36 g/mol, XLogP of 3.48, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N,N-diethyl-2-naphthalen-1-yloxypropanamide is sourced from PubChem (CID 13013865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).