2-(2-benzoylpyrrol-1-yl)-N-(2-morpholin-4-ylethyl)acetamide

C19H23N3O3 — CID 3238743

IUPAC2-(2-benzoylpyrrol-1-yl)-N-(2-morpholin-4-ylethyl)acetamide
SMILESO=C(Cn1cccc1C(=O)c1ccccc1)NCCN1CCOCC1
InChIInChI=1S/C19H23N3O3/c23-18(20-8-10-21-11-13-25-14-12-21)15-22-9-4-7-17(22)19(24)16-5-2-1-3-6-16/h1-7,9H,8,10-15H2,(H,20,23)
InChIKeyMWHVPNZCYOROBW-UHFFFAOYSA-N
MW341.41 g/mol
LogP1.17
Rot. Bonds7

About 2-(2-benzoylpyrrol-1-yl)-N-(2-morpholin-4-ylethyl)acetamide

2-(2-benzoylpyrrol-1-yl)-N-(2-morpholin-4-ylethyl)acetamide (PubChem CID 3238743) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is 2-(2-benzoylpyrrol-1-yl)-N-(2-morpholin-4-ylethyl)acetamide.

Molecular Properties

Compound Name2-(2-benzoylpyrrol-1-yl)-N-(2-morpholin-4-ylethyl)acetamide
PubChem CID3238743
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC Name2-(2-benzoylpyrrol-1-yl)-N-(2-morpholin-4-ylethyl)acetamide
SMILESO=C(Cn1cccc1C(=O)c1ccccc1)NCCN1CCOCC1
InChIInChI=1S/C19H23N3O3/c23-18(20-8-10-21-11-13-25-14-12-21)15-22-9-4-7-17(22)19(24)16-5-2-1-3-6-16/h1-7,9H,8,10-15H2,(H,20,23)
InChIKeyMWHVPNZCYOROBW-UHFFFAOYSA-N
XLogP1.17
TPSA63.57 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(2-benzoylpyrrol-1-yl)-N-(2-morpholin-4-ylethyl)acetamide?
The IUPAC name of 2-(2-benzoylpyrrol-1-yl)-N-(2-morpholin-4-ylethyl)acetamide (CID 3238743) is 2-(2-benzoylpyrrol-1-yl)-N-(2-morpholin-4-ylethyl)acetamide.
What is the SMILES notation for 2-(2-benzoylpyrrol-1-yl)-N-(2-morpholin-4-ylethyl)acetamide?
The canonical SMILES for 2-(2-benzoylpyrrol-1-yl)-N-(2-morpholin-4-ylethyl)acetamide is O=C(Cn1cccc1C(=O)c1ccccc1)NCCN1CCOCC1.
What is the InChIKey of 2-(2-benzoylpyrrol-1-yl)-N-(2-morpholin-4-ylethyl)acetamide?
The InChIKey is MWHVPNZCYOROBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3/c23-18(20-8-10-21-11-13-25-14-12-21)15-22-9-4-7-17(22)19(24)16-5-2-1-3-6-16/h1-7,9H,8,10-15H2,(H,20,23).
What are the key properties of 2-(2-benzoylpyrrol-1-yl)-N-(2-morpholin-4-ylethyl)acetamide?
2-(2-benzoylpyrrol-1-yl)-N-(2-morpholin-4-ylethyl)acetamide has a molecular weight of 341.41 g/mol, XLogP of 1.17, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-benzoylpyrrol-1-yl)-N-(2-morpholin-4-ylethyl)acetamide is sourced from PubChem (CID 3238743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).