2-cyclopropyl-N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]propanamide

C20H30N2O3 — CID 110621760

IUPAC2-cyclopropyl-N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]propanamide
SMILESCCOc1ccc(C(CNC(=O)C(C)C2CC2)N2CCOCC2)cc1
InChIInChI=1S/C20H30N2O3/c1-3-25-18-8-6-17(7-9-18)19(22-10-12-24-13-11-22)14-21-20(23)15(2)16-4-5-16/h6-9,15-16,19H,3-5,10-14H2,1-2H3,(H,21,23)
InChIKeyDASFUJTVNKPJKN-UHFFFAOYSA-N
MW346.47 g/mol
LogP2.62
Rot. Bonds8

About 2-cyclopropyl-N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]propanamide

2-cyclopropyl-N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]propanamide (PubChem CID 110621760) has the molecular formula C20H30N2O3 and a molecular weight of 346.47 g/mol. Its IUPAC name is 2-cyclopropyl-N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]propanamide.

Molecular Properties

Compound Name2-cyclopropyl-N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]propanamide
PubChem CID110621760
Molecular FormulaC20H30N2O3
Molecular Weight346.47 g/mol
Exact Mass346.23
IUPAC Name2-cyclopropyl-N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]propanamide
SMILESCCOc1ccc(C(CNC(=O)C(C)C2CC2)N2CCOCC2)cc1
InChIInChI=1S/C20H30N2O3/c1-3-25-18-8-6-17(7-9-18)19(22-10-12-24-13-11-22)14-21-20(23)15(2)16-4-5-16/h6-9,15-16,19H,3-5,10-14H2,1-2H3,(H,21,23)
InChIKeyDASFUJTVNKPJKN-UHFFFAOYSA-N
XLogP2.62
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.47
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]propanamide?
The IUPAC name of 2-cyclopropyl-N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]propanamide (CID 110621760) is 2-cyclopropyl-N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]propanamide.
What is the SMILES notation for 2-cyclopropyl-N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]propanamide?
The canonical SMILES for 2-cyclopropyl-N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]propanamide is CCOc1ccc(C(CNC(=O)C(C)C2CC2)N2CCOCC2)cc1.
What is the InChIKey of 2-cyclopropyl-N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]propanamide?
The InChIKey is DASFUJTVNKPJKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N2O3/c1-3-25-18-8-6-17(7-9-18)19(22-10-12-24-13-11-22)14-21-20(23)15(2)16-4-5-16/h6-9,15-16,19H,3-5,10-14H2,1-2H3,(H,21,23).
What are the key properties of 2-cyclopropyl-N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]propanamide?
2-cyclopropyl-N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]propanamide has a molecular weight of 346.47 g/mol, XLogP of 2.62, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]propanamide is sourced from PubChem (CID 110621760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).