2-(diethylamino)-N-ethyl-N-(2-phenoxyethyl)acetamide;hydrochloride

C16H27ClN2O2 — CID 3060133

IUPAC2-(diethylamino)-N-ethyl-N-(2-phenoxyethyl)acetamide;hydrochloride
SMILESCCN(CC)CC(=O)N(CC)CCOc1ccccc1.Cl
InChIInChI=1S/C16H26N2O2.ClH/c1-4-17(5-2)14-16(19)18(6-3)12-13-20-15-10-8-7-9-11-15;/h7-11H,4-6,12-14H2,1-3H3;1H
InChIKeyPDDPHZXARVJKPJ-UHFFFAOYSA-N
MW314.86 g/mol
LogP2.68
Rot. Bonds9

About 2-(diethylamino)-N-ethyl-N-(2-phenoxyethyl)acetamide;hydrochloride

2-(diethylamino)-N-ethyl-N-(2-phenoxyethyl)acetamide;hydrochloride (PubChem CID 3060133) has the molecular formula C16H27ClN2O2 and a molecular weight of 314.86 g/mol. Its IUPAC name is 2-(diethylamino)-N-ethyl-N-(2-phenoxyethyl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-(diethylamino)-N-ethyl-N-(2-phenoxyethyl)acetamide;hydrochloride
PubChem CID3060133
Molecular FormulaC16H27ClN2O2
Molecular Weight314.86 g/mol
Exact Mass314.18
IUPAC Name2-(diethylamino)-N-ethyl-N-(2-phenoxyethyl)acetamide;hydrochloride
SMILESCCN(CC)CC(=O)N(CC)CCOc1ccccc1.Cl
InChIInChI=1S/C16H26N2O2.ClH/c1-4-17(5-2)14-16(19)18(6-3)12-13-20-15-10-8-7-9-11-15;/h7-11H,4-6,12-14H2,1-3H3;1H
InChIKeyPDDPHZXARVJKPJ-UHFFFAOYSA-N
XLogP2.68
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.86
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(diethylamino)-N-ethyl-N-(2-phenoxyethyl)acetamide;hydrochloride?
The IUPAC name of 2-(diethylamino)-N-ethyl-N-(2-phenoxyethyl)acetamide;hydrochloride (CID 3060133) is 2-(diethylamino)-N-ethyl-N-(2-phenoxyethyl)acetamide;hydrochloride.
What is the SMILES notation for 2-(diethylamino)-N-ethyl-N-(2-phenoxyethyl)acetamide;hydrochloride?
The canonical SMILES for 2-(diethylamino)-N-ethyl-N-(2-phenoxyethyl)acetamide;hydrochloride is CCN(CC)CC(=O)N(CC)CCOc1ccccc1.Cl.
What is the InChIKey of 2-(diethylamino)-N-ethyl-N-(2-phenoxyethyl)acetamide;hydrochloride?
The InChIKey is PDDPHZXARVJKPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2.ClH/c1-4-17(5-2)14-16(19)18(6-3)12-13-20-15-10-8-7-9-11-15;/h7-11H,4-6,12-14H2,1-3H3;1H.
What are the key properties of 2-(diethylamino)-N-ethyl-N-(2-phenoxyethyl)acetamide;hydrochloride?
2-(diethylamino)-N-ethyl-N-(2-phenoxyethyl)acetamide;hydrochloride has a molecular weight of 314.86 g/mol, XLogP of 2.68, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(diethylamino)-N-ethyl-N-(2-phenoxyethyl)acetamide;hydrochloride is sourced from PubChem (CID 3060133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).