2-morpholin-4-yl-N-(2-phenyl-1,3-benzoxazol-5-yl)acetamide

C19H19N3O3 — CID 5275497

IUPAC2-morpholin-4-yl-N-(2-phenyl-1,3-benzoxazol-5-yl)acetamide
SMILESO=C(CN1CCOCC1)Nc1ccc2oc(-c3ccccc3)nc2c1
InChIInChI=1S/C19H19N3O3/c23-18(13-22-8-10-24-11-9-22)20-15-6-7-17-16(12-15)21-19(25-17)14-4-2-1-3-5-14/h1-7,12H,8-11,13H2,(H,20,23)
InChIKeyKGTONKVGVCCGEO-UHFFFAOYSA-N
MW337.38 g/mol
LogP2.77
Rot. Bonds4

About 2-morpholin-4-yl-N-(2-phenyl-1,3-benzoxazol-5-yl)acetamide

2-morpholin-4-yl-N-(2-phenyl-1,3-benzoxazol-5-yl)acetamide (PubChem CID 5275497) has the molecular formula C19H19N3O3 and a molecular weight of 337.38 g/mol. Its IUPAC name is 2-morpholin-4-yl-N-(2-phenyl-1,3-benzoxazol-5-yl)acetamide.

Molecular Properties

Compound Name2-morpholin-4-yl-N-(2-phenyl-1,3-benzoxazol-5-yl)acetamide
PubChem CID5275497
Molecular FormulaC19H19N3O3
Molecular Weight337.38 g/mol
Exact Mass337.14
IUPAC Name2-morpholin-4-yl-N-(2-phenyl-1,3-benzoxazol-5-yl)acetamide
SMILESO=C(CN1CCOCC1)Nc1ccc2oc(-c3ccccc3)nc2c1
InChIInChI=1S/C19H19N3O3/c23-18(13-22-8-10-24-11-9-22)20-15-6-7-17-16(12-15)21-19(25-17)14-4-2-1-3-5-14/h1-7,12H,8-11,13H2,(H,20,23)
InChIKeyKGTONKVGVCCGEO-UHFFFAOYSA-N
XLogP2.77
TPSA67.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-yl-N-(2-phenyl-1,3-benzoxazol-5-yl)acetamide?
The IUPAC name of 2-morpholin-4-yl-N-(2-phenyl-1,3-benzoxazol-5-yl)acetamide (CID 5275497) is 2-morpholin-4-yl-N-(2-phenyl-1,3-benzoxazol-5-yl)acetamide.
What is the SMILES notation for 2-morpholin-4-yl-N-(2-phenyl-1,3-benzoxazol-5-yl)acetamide?
The canonical SMILES for 2-morpholin-4-yl-N-(2-phenyl-1,3-benzoxazol-5-yl)acetamide is O=C(CN1CCOCC1)Nc1ccc2oc(-c3ccccc3)nc2c1.
What is the InChIKey of 2-morpholin-4-yl-N-(2-phenyl-1,3-benzoxazol-5-yl)acetamide?
The InChIKey is KGTONKVGVCCGEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O3/c23-18(13-22-8-10-24-11-9-22)20-15-6-7-17-16(12-15)21-19(25-17)14-4-2-1-3-5-14/h1-7,12H,8-11,13H2,(H,20,23).
What are the key properties of 2-morpholin-4-yl-N-(2-phenyl-1,3-benzoxazol-5-yl)acetamide?
2-morpholin-4-yl-N-(2-phenyl-1,3-benzoxazol-5-yl)acetamide has a molecular weight of 337.38 g/mol, XLogP of 2.77, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-yl-N-(2-phenyl-1,3-benzoxazol-5-yl)acetamide is sourced from PubChem (CID 5275497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).