2-morpholin-4-ium-4-yl-N-(2-phenylphenyl)acetamide

C18H21N2O2+ — CID 6951855

IUPAC2-morpholin-4-ium-4-yl-N-(2-phenylphenyl)acetamide
SMILESO=C(C[NH+]1CCOCC1)Nc1ccccc1-c1ccccc1
InChIInChI=1S/C18H20N2O2/c21-18(14-20-10-12-22-13-11-20)19-17-9-5-4-8-16(17)15-6-2-1-3-7-15/h1-9H,10-14H2,(H,19,21)/p+1
InChIKeyKKMRSRQJJJEGNL-UHFFFAOYSA-O
MW297.38 g/mol
LogP1.21
Rot. Bonds4

About 2-morpholin-4-ium-4-yl-N-(2-phenylphenyl)acetamide

2-morpholin-4-ium-4-yl-N-(2-phenylphenyl)acetamide (PubChem CID 6951855) has the molecular formula C18H21N2O2+ and a molecular weight of 297.38 g/mol. Its IUPAC name is 2-morpholin-4-ium-4-yl-N-(2-phenylphenyl)acetamide.

Molecular Properties

Compound Name2-morpholin-4-ium-4-yl-N-(2-phenylphenyl)acetamide
PubChem CID6951855
Molecular FormulaC18H21N2O2+
Molecular Weight297.38 g/mol
Exact Mass297.16
IUPAC Name2-morpholin-4-ium-4-yl-N-(2-phenylphenyl)acetamide
SMILESO=C(C[NH+]1CCOCC1)Nc1ccccc1-c1ccccc1
InChIInChI=1S/C18H20N2O2/c21-18(14-20-10-12-22-13-11-20)19-17-9-5-4-8-16(17)15-6-2-1-3-7-15/h1-9H,10-14H2,(H,19,21)/p+1
InChIKeyKKMRSRQJJJEGNL-UHFFFAOYSA-O
XLogP1.21
TPSA42.77 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.38
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-ium-4-yl-N-(2-phenylphenyl)acetamide?
The IUPAC name of 2-morpholin-4-ium-4-yl-N-(2-phenylphenyl)acetamide (CID 6951855) is 2-morpholin-4-ium-4-yl-N-(2-phenylphenyl)acetamide.
What is the SMILES notation for 2-morpholin-4-ium-4-yl-N-(2-phenylphenyl)acetamide?
The canonical SMILES for 2-morpholin-4-ium-4-yl-N-(2-phenylphenyl)acetamide is O=C(C[NH+]1CCOCC1)Nc1ccccc1-c1ccccc1.
What is the InChIKey of 2-morpholin-4-ium-4-yl-N-(2-phenylphenyl)acetamide?
The InChIKey is KKMRSRQJJJEGNL-UHFFFAOYSA-O. The full InChI is InChI=1S/C18H20N2O2/c21-18(14-20-10-12-22-13-11-20)19-17-9-5-4-8-16(17)15-6-2-1-3-7-15/h1-9H,10-14H2,(H,19,21)/p+1.
What are the key properties of 2-morpholin-4-ium-4-yl-N-(2-phenylphenyl)acetamide?
2-morpholin-4-ium-4-yl-N-(2-phenylphenyl)acetamide has a molecular weight of 297.38 g/mol, XLogP of 1.21, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-ium-4-yl-N-(2-phenylphenyl)acetamide is sourced from PubChem (CID 6951855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).