N-(2-ethoxyethyl)-N-ethylbenzamide

C13H19NO2 — CID 63718241

IUPACN-(2-ethoxyethyl)-N-ethylbenzamide
SMILESCCOCCN(CC)C(=O)c1ccccc1
InChIInChI=1S/C13H19NO2/c1-3-14(10-11-16-4-2)13(15)12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3
InChIKeyDPYWNGBUPUZCCD-UHFFFAOYSA-N
MW221.30 g/mol
LogP2.19
Rot. Bonds6

About N-(2-ethoxyethyl)-N-ethylbenzamide

N-(2-ethoxyethyl)-N-ethylbenzamide (PubChem CID 63718241) has the molecular formula C13H19NO2 and a molecular weight of 221.30 g/mol. Its IUPAC name is N-(2-ethoxyethyl)-N-ethylbenzamide.

Molecular Properties

Compound NameN-(2-ethoxyethyl)-N-ethylbenzamide
PubChem CID63718241
Molecular FormulaC13H19NO2
Molecular Weight221.30 g/mol
Exact Mass221.14
IUPAC NameN-(2-ethoxyethyl)-N-ethylbenzamide
SMILESCCOCCN(CC)C(=O)c1ccccc1
InChIInChI=1S/C13H19NO2/c1-3-14(10-11-16-4-2)13(15)12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3
InChIKeyDPYWNGBUPUZCCD-UHFFFAOYSA-N
XLogP2.19
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(2-ethoxyethyl)-N-methylbenzamide
CID 81074695
3-(2-aminoethyl)-N-(2-ethoxyethyl)-N-ethylbenzamide
CID 63697515
3-[2-ethoxyethyl(ethyl)carbamoyl]benzenesulfonyl chloride
CID 63691803
N-(2-ethoxyethyl)-N-ethylbenzenecarboximidamide
CID 63692580
CID 174412487
CID 174412487
(2R)-2-amino-N-(2-ethoxyethyl)-N-ethyl-2-phenylacetamide
CID 63692706
6-amino-N-(2-ethoxyethyl)-N-ethylpyridine-3-carboxamide
CID 63690796
N-(2-ethoxyethyl)-N-ethyl-4-fluoro-3-methylbenzamide
CID 63692679
3-chloro-N-(2-ethoxyethyl)-N-ethyl-4-hydroxybenzamide
CID 63692359
ethane;N-ethyl-N-[2-[ethyl(methyl)amino]ethyl]benzamide
CID 143933020
4-(chloromethyl)-N,N-bis(2-ethoxyethyl)benzamide
CID 82960871
N-ethyl-N-[2-(ethylamino)ethyl]benzamide
CID 12892915

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyethyl)-N-ethylbenzamide?
The IUPAC name of N-(2-ethoxyethyl)-N-ethylbenzamide (CID 63718241) is N-(2-ethoxyethyl)-N-ethylbenzamide.
What is the SMILES notation for N-(2-ethoxyethyl)-N-ethylbenzamide?
The canonical SMILES for N-(2-ethoxyethyl)-N-ethylbenzamide is CCOCCN(CC)C(=O)c1ccccc1.
What is the InChIKey of N-(2-ethoxyethyl)-N-ethylbenzamide?
The InChIKey is DPYWNGBUPUZCCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO2/c1-3-14(10-11-16-4-2)13(15)12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3.
What are the key properties of N-(2-ethoxyethyl)-N-ethylbenzamide?
N-(2-ethoxyethyl)-N-ethylbenzamide has a molecular weight of 221.30 g/mol, XLogP of 2.19, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyethyl)-N-ethylbenzamide is sourced from PubChem (CID 63718241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).