N-[2-(diethylamino)ethyl]-2-naphthalen-2-yloxypropanamide

C19H26N2O2 — CID 45147924

IUPACN-[2-(diethylamino)ethyl]-2-naphthalen-2-yloxypropanamide
SMILESCCN(CC)CCNC(=O)C(C)Oc1ccc2ccccc2c1
InChIInChI=1S/C19H26N2O2/c1-4-21(5-2)13-12-20-19(22)15(3)23-18-11-10-16-8-6-7-9-17(16)14-18/h6-11,14-15H,4-5,12-13H2,1-3H3,(H,20,22)
InChIKeyMGIZYQVKVCAFOP-UHFFFAOYSA-N
MW314.43 g/mol
LogP3.07
Rot. Bonds8

About N-[2-(diethylamino)ethyl]-2-naphthalen-2-yloxypropanamide

N-[2-(diethylamino)ethyl]-2-naphthalen-2-yloxypropanamide (PubChem CID 45147924) has the molecular formula C19H26N2O2 and a molecular weight of 314.43 g/mol. Its IUPAC name is N-[2-(diethylamino)ethyl]-2-naphthalen-2-yloxypropanamide.

Molecular Properties

Compound NameN-[2-(diethylamino)ethyl]-2-naphthalen-2-yloxypropanamide
PubChem CID45147924
Molecular FormulaC19H26N2O2
Molecular Weight314.43 g/mol
Exact Mass314.20
IUPAC NameN-[2-(diethylamino)ethyl]-2-naphthalen-2-yloxypropanamide
SMILESCCN(CC)CCNC(=O)C(C)Oc1ccc2ccccc2c1
InChIInChI=1S/C19H26N2O2/c1-4-21(5-2)13-12-20-19(22)15(3)23-18-11-10-16-8-6-7-9-17(16)14-18/h6-11,14-15H,4-5,12-13H2,1-3H3,(H,20,22)
InChIKeyMGIZYQVKVCAFOP-UHFFFAOYSA-N
XLogP3.07
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.43
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(diethylamino)ethyl]-2-naphthalen-2-yloxypropanamide?
The IUPAC name of N-[2-(diethylamino)ethyl]-2-naphthalen-2-yloxypropanamide (CID 45147924) is N-[2-(diethylamino)ethyl]-2-naphthalen-2-yloxypropanamide.
What is the SMILES notation for N-[2-(diethylamino)ethyl]-2-naphthalen-2-yloxypropanamide?
The canonical SMILES for N-[2-(diethylamino)ethyl]-2-naphthalen-2-yloxypropanamide is CCN(CC)CCNC(=O)C(C)Oc1ccc2ccccc2c1.
What is the InChIKey of N-[2-(diethylamino)ethyl]-2-naphthalen-2-yloxypropanamide?
The InChIKey is MGIZYQVKVCAFOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O2/c1-4-21(5-2)13-12-20-19(22)15(3)23-18-11-10-16-8-6-7-9-17(16)14-18/h6-11,14-15H,4-5,12-13H2,1-3H3,(H,20,22).
What are the key properties of N-[2-(diethylamino)ethyl]-2-naphthalen-2-yloxypropanamide?
N-[2-(diethylamino)ethyl]-2-naphthalen-2-yloxypropanamide has a molecular weight of 314.43 g/mol, XLogP of 3.07, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(diethylamino)ethyl]-2-naphthalen-2-yloxypropanamide is sourced from PubChem (CID 45147924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).