N-[2-(dimethylamino)ethyl]-4-ethoxybenzamide

C13H20N2O2 — CID 891344

IUPACN-[2-(dimethylamino)ethyl]-4-ethoxybenzamide
SMILESCCOc1ccc(C(=O)NCCN(C)C)cc1
InChIInChI=1S/C13H20N2O2/c1-4-17-12-7-5-11(6-8-12)13(16)14-9-10-15(2)3/h5-8H,4,9-10H2,1-3H3,(H,14,16)
InChIKeyHESNNBCFODDNMA-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.38
Rot. Bonds6

About N-[2-(dimethylamino)ethyl]-4-ethoxybenzamide

N-[2-(dimethylamino)ethyl]-4-ethoxybenzamide (PubChem CID 891344) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-4-ethoxybenzamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-4-ethoxybenzamide
PubChem CID891344
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC NameN-[2-(dimethylamino)ethyl]-4-ethoxybenzamide
SMILESCCOc1ccc(C(=O)NCCN(C)C)cc1
InChIInChI=1S/C13H20N2O2/c1-4-17-12-7-5-11(6-8-12)13(16)14-9-10-15(2)3/h5-8H,4,9-10H2,1-3H3,(H,14,16)
InChIKeyHESNNBCFODDNMA-UHFFFAOYSA-N
XLogP1.38
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-4-ethoxybenzamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-4-ethoxybenzamide (CID 891344) is N-[2-(dimethylamino)ethyl]-4-ethoxybenzamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-4-ethoxybenzamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-4-ethoxybenzamide is CCOc1ccc(C(=O)NCCN(C)C)cc1.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-4-ethoxybenzamide?
The InChIKey is HESNNBCFODDNMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-4-17-12-7-5-11(6-8-12)13(16)14-9-10-15(2)3/h5-8H,4,9-10H2,1-3H3,(H,14,16).
What are the key properties of N-[2-(dimethylamino)ethyl]-4-ethoxybenzamide?
N-[2-(dimethylamino)ethyl]-4-ethoxybenzamide has a molecular weight of 236.31 g/mol, XLogP of 1.38, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-4-ethoxybenzamide is sourced from PubChem (CID 891344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).