2-ethoxy-N-morpholin-4-ylbenzamide

C13H18N2O3 — CID 4053296

IUPAC2-ethoxy-N-morpholin-4-ylbenzamide
SMILESCCOc1ccccc1C(=O)NN1CCOCC1
InChIInChI=1S/C13H18N2O3/c1-2-18-12-6-4-3-5-11(12)13(16)14-15-7-9-17-10-8-15/h3-6H,2,7-10H2,1H3,(H,14,16)
InChIKeyPEAAPRIGRRTTFR-UHFFFAOYSA-N
MW250.30 g/mol
LogP1.06
Rot. Bonds4

About 2-ethoxy-N-morpholin-4-ylbenzamide

2-ethoxy-N-morpholin-4-ylbenzamide (PubChem CID 4053296) has the molecular formula C13H18N2O3 and a molecular weight of 250.30 g/mol. Its IUPAC name is 2-ethoxy-N-morpholin-4-ylbenzamide.

Molecular Properties

Compound Name2-ethoxy-N-morpholin-4-ylbenzamide
PubChem CID4053296
Molecular FormulaC13H18N2O3
Molecular Weight250.30 g/mol
Exact Mass250.13
IUPAC Name2-ethoxy-N-morpholin-4-ylbenzamide
SMILESCCOc1ccccc1C(=O)NN1CCOCC1
InChIInChI=1S/C13H18N2O3/c1-2-18-12-6-4-3-5-11(12)13(16)14-15-7-9-17-10-8-15/h3-6H,2,7-10H2,1H3,(H,14,16)
InChIKeyPEAAPRIGRRTTFR-UHFFFAOYSA-N
XLogP1.06
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-morpholin-4-ylbenzamide?
The IUPAC name of 2-ethoxy-N-morpholin-4-ylbenzamide (CID 4053296) is 2-ethoxy-N-morpholin-4-ylbenzamide.
What is the SMILES notation for 2-ethoxy-N-morpholin-4-ylbenzamide?
The canonical SMILES for 2-ethoxy-N-morpholin-4-ylbenzamide is CCOc1ccccc1C(=O)NN1CCOCC1.
What is the InChIKey of 2-ethoxy-N-morpholin-4-ylbenzamide?
The InChIKey is PEAAPRIGRRTTFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O3/c1-2-18-12-6-4-3-5-11(12)13(16)14-15-7-9-17-10-8-15/h3-6H,2,7-10H2,1H3,(H,14,16).
What are the key properties of 2-ethoxy-N-morpholin-4-ylbenzamide?
2-ethoxy-N-morpholin-4-ylbenzamide has a molecular weight of 250.30 g/mol, XLogP of 1.06, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-morpholin-4-ylbenzamide is sourced from PubChem (CID 4053296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).