1-morpholin-4-yl-3-(5-phenyl-1H-pyrrol-2-yl)propan-1-one

C17H20N2O2 — CID 51088025

IUPAC1-morpholin-4-yl-3-(5-phenyl-1H-pyrrol-2-yl)propan-1-one
SMILESO=C(CCc1ccc(-c2ccccc2)[nH]1)N1CCOCC1
InChIInChI=1S/C17H20N2O2/c20-17(19-10-12-21-13-11-19)9-7-15-6-8-16(18-15)14-4-2-1-3-5-14/h1-6,8,18H,7,9-13H2
InChIKeySIBUTQDMPSCGCY-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.47
Rot. Bonds4

About 1-morpholin-4-yl-3-(5-phenyl-1H-pyrrol-2-yl)propan-1-one

1-morpholin-4-yl-3-(5-phenyl-1H-pyrrol-2-yl)propan-1-one (PubChem CID 51088025) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 1-morpholin-4-yl-3-(5-phenyl-1H-pyrrol-2-yl)propan-1-one.

Molecular Properties

Compound Name1-morpholin-4-yl-3-(5-phenyl-1H-pyrrol-2-yl)propan-1-one
PubChem CID51088025
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name1-morpholin-4-yl-3-(5-phenyl-1H-pyrrol-2-yl)propan-1-one
SMILESO=C(CCc1ccc(-c2ccccc2)[nH]1)N1CCOCC1
InChIInChI=1S/C17H20N2O2/c20-17(19-10-12-21-13-11-19)9-7-15-6-8-16(18-15)14-4-2-1-3-5-14/h1-6,8,18H,7,9-13H2
InChIKeySIBUTQDMPSCGCY-UHFFFAOYSA-N
XLogP2.47
TPSA45.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-morpholin-4-yl-3-(5-phenyl-1H-pyrrol-2-yl)propan-1-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[(3S)-3-hydroxypyrrolidin-1-yl]-3-(5-phenyl-1H-pyrrol-2-yl)propan-1-one
CID 131962852
1-morpholin-4-yl-3-phenylpropan-1-one
CID 532825
(3S)-1-[3-(5-phenyl-1H-pyrrol-2-yl)propanoyl]pyrrolidine-3-carboxamide
CID 94657897
3-methyl-1-[3-(5-phenyl-1H-pyrrol-2-yl)propanoyl]pyrrolidine-3-carboxylic acid
CID 119256480
N-[4-fluoro-3-(3-morpholin-4-ylpropanoylamino)phenyl]-3-(5-phenyl-1H-pyrrol-2-yl)propanamide
CID 55964556
1-morpholin-4-yl-3-[3-(4-phenylphenyl)-1,2,4-oxadiazol-5-yl]propan-1-one
CID 100762654
1-[4-(2-morpholin-4-ylethyl)piperazin-1-yl]-3-phenylpropan-1-one
CID 113073687
4-(2-bromophenyl)-1-morpholin-4-ylbutan-1-one
CID 166222857
4-morpholin-4-yl-4-oxo-N-phenylbutanamide
CID 9341047
3-[5-(3-fluorophenyl)-1-phenylpyrazol-3-yl]-1-morpholin-4-ylpropan-1-one
CID 67997408
2-(4,5-diphenyl-1H-imidazol-2-yl)-1-morpholin-4-ylethanone
CID 54562196
1-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)-3-(5-phenyl-1H-pyrrol-2-yl)propan-1-one
CID 55910216

Frequently Asked Questions

What is the IUPAC name of 1-morpholin-4-yl-3-(5-phenyl-1H-pyrrol-2-yl)propan-1-one?
The IUPAC name of 1-morpholin-4-yl-3-(5-phenyl-1H-pyrrol-2-yl)propan-1-one (CID 51088025) is 1-morpholin-4-yl-3-(5-phenyl-1H-pyrrol-2-yl)propan-1-one.
What is the SMILES notation for 1-morpholin-4-yl-3-(5-phenyl-1H-pyrrol-2-yl)propan-1-one?
The canonical SMILES for 1-morpholin-4-yl-3-(5-phenyl-1H-pyrrol-2-yl)propan-1-one is O=C(CCc1ccc(-c2ccccc2)[nH]1)N1CCOCC1.
What is the InChIKey of 1-morpholin-4-yl-3-(5-phenyl-1H-pyrrol-2-yl)propan-1-one?
The InChIKey is SIBUTQDMPSCGCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c20-17(19-10-12-21-13-11-19)9-7-15-6-8-16(18-15)14-4-2-1-3-5-14/h1-6,8,18H,7,9-13H2.
What are the key properties of 1-morpholin-4-yl-3-(5-phenyl-1H-pyrrol-2-yl)propan-1-one?
1-morpholin-4-yl-3-(5-phenyl-1H-pyrrol-2-yl)propan-1-one has a molecular weight of 284.36 g/mol, XLogP of 2.47, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-morpholin-4-yl-3-(5-phenyl-1H-pyrrol-2-yl)propan-1-one is sourced from PubChem (CID 51088025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).