3-morpholin-4-yl-N-phenylpropanamide

C13H18N2O2 — CID 2901601

IUPAC3-morpholin-4-yl-N-phenylpropanamide
SMILESO=C(CCN1CCOCC1)Nc1ccccc1
InChIInChI=1S/C13H18N2O2/c16-13(14-12-4-2-1-3-5-12)6-7-15-8-10-17-11-9-15/h1-5H,6-11H2,(H,14,16)
InChIKeyYMNVJDSZHKBYON-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.35
Rot. Bonds4

About 3-morpholin-4-yl-N-phenylpropanamide

3-morpholin-4-yl-N-phenylpropanamide (PubChem CID 2901601) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is 3-morpholin-4-yl-N-phenylpropanamide.

Molecular Properties

Compound Name3-morpholin-4-yl-N-phenylpropanamide
PubChem CID2901601
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC Name3-morpholin-4-yl-N-phenylpropanamide
SMILESO=C(CCN1CCOCC1)Nc1ccccc1
InChIInChI=1S/C13H18N2O2/c16-13(14-12-4-2-1-3-5-12)6-7-15-8-10-17-11-9-15/h1-5H,6-11H2,(H,14,16)
InChIKeyYMNVJDSZHKBYON-UHFFFAOYSA-N
XLogP1.35
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-morpholin-4-yl-N-phenylpropanamide?
The IUPAC name of 3-morpholin-4-yl-N-phenylpropanamide (CID 2901601) is 3-morpholin-4-yl-N-phenylpropanamide.
What is the SMILES notation for 3-morpholin-4-yl-N-phenylpropanamide?
The canonical SMILES for 3-morpholin-4-yl-N-phenylpropanamide is O=C(CCN1CCOCC1)Nc1ccccc1.
What is the InChIKey of 3-morpholin-4-yl-N-phenylpropanamide?
The InChIKey is YMNVJDSZHKBYON-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2/c16-13(14-12-4-2-1-3-5-12)6-7-15-8-10-17-11-9-15/h1-5H,6-11H2,(H,14,16).
What are the key properties of 3-morpholin-4-yl-N-phenylpropanamide?
3-morpholin-4-yl-N-phenylpropanamide has a molecular weight of 234.30 g/mol, XLogP of 1.35, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-morpholin-4-yl-N-phenylpropanamide is sourced from PubChem (CID 2901601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).