4-methoxy-N-(2-morpholin-4-ylethyl)-3-pentoxybenzamide

C19H30N2O4 — CID 19363436

IUPAC4-methoxy-N-(2-morpholin-4-ylethyl)-3-pentoxybenzamide
SMILESCCCCCOc1cc(C(=O)NCCN2CCOCC2)ccc1OC
InChIInChI=1S/C19H30N2O4/c1-3-4-5-12-25-18-15-16(6-7-17(18)23-2)19(22)20-8-9-21-10-13-24-14-11-21/h6-7,15H,3-5,8-14H2,1-2H3,(H,20,22)
InChIKeySOLXRXYZOADVTL-UHFFFAOYSA-N
MW350.46 g/mol
LogP2.33
Rot. Bonds10

About 4-methoxy-N-(2-morpholin-4-ylethyl)-3-pentoxybenzamide

4-methoxy-N-(2-morpholin-4-ylethyl)-3-pentoxybenzamide (PubChem CID 19363436) has the molecular formula C19H30N2O4 and a molecular weight of 350.46 g/mol. Its IUPAC name is 4-methoxy-N-(2-morpholin-4-ylethyl)-3-pentoxybenzamide.

Molecular Properties

Compound Name4-methoxy-N-(2-morpholin-4-ylethyl)-3-pentoxybenzamide
PubChem CID19363436
Molecular FormulaC19H30N2O4
Molecular Weight350.46 g/mol
Exact Mass350.22
IUPAC Name4-methoxy-N-(2-morpholin-4-ylethyl)-3-pentoxybenzamide
SMILESCCCCCOc1cc(C(=O)NCCN2CCOCC2)ccc1OC
InChIInChI=1S/C19H30N2O4/c1-3-4-5-12-25-18-15-16(6-7-17(18)23-2)19(22)20-8-9-21-10-13-24-14-11-21/h6-7,15H,3-5,8-14H2,1-2H3,(H,20,22)
InChIKeySOLXRXYZOADVTL-UHFFFAOYSA-N
XLogP2.33
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.46
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-(2-morpholin-4-ylethyl)-3-pentoxybenzamide?
The IUPAC name of 4-methoxy-N-(2-morpholin-4-ylethyl)-3-pentoxybenzamide (CID 19363436) is 4-methoxy-N-(2-morpholin-4-ylethyl)-3-pentoxybenzamide.
What is the SMILES notation for 4-methoxy-N-(2-morpholin-4-ylethyl)-3-pentoxybenzamide?
The canonical SMILES for 4-methoxy-N-(2-morpholin-4-ylethyl)-3-pentoxybenzamide is CCCCCOc1cc(C(=O)NCCN2CCOCC2)ccc1OC.
What is the InChIKey of 4-methoxy-N-(2-morpholin-4-ylethyl)-3-pentoxybenzamide?
The InChIKey is SOLXRXYZOADVTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2O4/c1-3-4-5-12-25-18-15-16(6-7-17(18)23-2)19(22)20-8-9-21-10-13-24-14-11-21/h6-7,15H,3-5,8-14H2,1-2H3,(H,20,22).
What are the key properties of 4-methoxy-N-(2-morpholin-4-ylethyl)-3-pentoxybenzamide?
4-methoxy-N-(2-morpholin-4-ylethyl)-3-pentoxybenzamide has a molecular weight of 350.46 g/mol, XLogP of 2.33, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-(2-morpholin-4-ylethyl)-3-pentoxybenzamide is sourced from PubChem (CID 19363436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).