4-(2-morpholin-4-ylethoxy)benzamide

C13H18N2O3 — CID 35813066

IUPAC4-(2-morpholin-4-ylethoxy)benzamide
SMILESNC(=O)c1ccc(OCCN2CCOCC2)cc1
InChIInChI=1S/C13H18N2O3/c14-13(16)11-1-3-12(4-2-11)18-10-7-15-5-8-17-9-6-15/h1-4H,5-10H2,(H2,14,16)
InChIKeyKMWQPTMWCCYVJH-UHFFFAOYSA-N
MW250.30 g/mol
LogP0.50
Rot. Bonds5

About 4-(2-morpholin-4-ylethoxy)benzamide

4-(2-morpholin-4-ylethoxy)benzamide (PubChem CID 35813066) has the molecular formula C13H18N2O3 and a molecular weight of 250.30 g/mol. Its IUPAC name is 4-(2-morpholin-4-ylethoxy)benzamide.

Molecular Properties

Compound Name4-(2-morpholin-4-ylethoxy)benzamide
PubChem CID35813066
Molecular FormulaC13H18N2O3
Molecular Weight250.30 g/mol
Exact Mass250.13
IUPAC Name4-(2-morpholin-4-ylethoxy)benzamide
SMILESNC(=O)c1ccc(OCCN2CCOCC2)cc1
InChIInChI=1S/C13H18N2O3/c14-13(16)11-1-3-12(4-2-11)18-10-7-15-5-8-17-9-6-15/h1-4H,5-10H2,(H2,14,16)
InChIKeyKMWQPTMWCCYVJH-UHFFFAOYSA-N
XLogP0.50
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(2-morpholin-4-ylethoxy)benzamide?
The IUPAC name of 4-(2-morpholin-4-ylethoxy)benzamide (CID 35813066) is 4-(2-morpholin-4-ylethoxy)benzamide.
What is the SMILES notation for 4-(2-morpholin-4-ylethoxy)benzamide?
The canonical SMILES for 4-(2-morpholin-4-ylethoxy)benzamide is NC(=O)c1ccc(OCCN2CCOCC2)cc1.
What is the InChIKey of 4-(2-morpholin-4-ylethoxy)benzamide?
The InChIKey is KMWQPTMWCCYVJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O3/c14-13(16)11-1-3-12(4-2-11)18-10-7-15-5-8-17-9-6-15/h1-4H,5-10H2,(H2,14,16).
What are the key properties of 4-(2-morpholin-4-ylethoxy)benzamide?
4-(2-morpholin-4-ylethoxy)benzamide has a molecular weight of 250.30 g/mol, XLogP of 0.50, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-morpholin-4-ylethoxy)benzamide is sourced from PubChem (CID 35813066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).