2-Pyrrolidinone, 4-(morpholinocarbonyl)-1-phenyl-

C15H18N2O3 — CID 217788

IUPAC4-(morpholine-4-carbonyl)-1-phenylpyrrolidin-2-one
SMILESC1COCCN1C(=O)C2CC(=O)N(C2)C3=CC=CC=C3
InChIInChI=1S/C15H18N2O3/c18-14-10-12(15(19)16-6-8-20-9-7-16)11-17(14)13-4-2-1-3-5-13/h1-5,12H,6-11H2
InChIKeyDBZMAKNIJBUOLD-UHFFFAOYSA-N
MW274.31 g/mol
LogP0.10
Rot. Bonds2

About 2-Pyrrolidinone, 4-(morpholinocarbonyl)-1-phenyl-

2-Pyrrolidinone, 4-(morpholinocarbonyl)-1-phenyl- (PubChem CID 217788) has the molecular formula C15H18N2O3 and a molecular weight of 274.31 g/mol. Its IUPAC name is 4-(morpholine-4-carbonyl)-1-phenylpyrrolidin-2-one.

Molecular Properties

Compound Name2-Pyrrolidinone, 4-(morpholinocarbonyl)-1-phenyl-
PubChem CID217788
Molecular FormulaC15H18N2O3
Molecular Weight274.31 g/mol
Exact Mass274.13
IUPAC Name4-(morpholine-4-carbonyl)-1-phenylpyrrolidin-2-one
SMILESC1COCCN1C(=O)C2CC(=O)N(C2)C3=CC=CC=C3
InChIInChI=1S/C15H18N2O3/c18-14-10-12(15(19)16-6-8-20-9-7-16)11-17(14)13-4-2-1-3-5-13/h1-5,12H,6-11H2
InChIKeyDBZMAKNIJBUOLD-UHFFFAOYSA-N
XLogP0.10
TPSA49.90 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity373

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.31
LogP ≤ 50.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-Phenyl-2-piperidinosuccinimide
CID 250855
N-(beta-hydroxy-gamma-(N-phenylpiperazinepropyl))-2-pyrrolidinone
CID 3035813
1-(4-Chlorophenyl)-4-(morpholine-4-carbonyl)pyrrolidin-2-one
CID 217803
1-cyclohexyl-5-oxo-N-phenylpyrrolidine-3-carboxamide
CID 2883505
N-(4-Amino-phenyl)-3-morpholin-4-yl-propionamide
CID 844901
1-(3-Methylphenyl)-3-morpholin-4-ylazolidine-2,5-dione
CID 2827709
1-(4-methylphenyl)-N-(2-morpholin-4-ylethyl)-5-oxopyrrolidine-3-carboxamide
CID 2963140
4-(1-Azepanylcarbonyl)-1-phenyl-2-pyrrolidinone
CID 2978143
N-[3-(morpholin-4-yl)propyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide
CID 6461546
1-(3,4-Dimethylphenyl)-4-(morpholine-4-carbonyl)pyrrolidin-2-one
CID 6462003
1-(4-chlorophenyl)-N-(2-morpholin-4-ylethyl)-5-oxopyrrolidine-3-carboxamide
CID 6462588
1-(4-Chlorophenyl)-4-(2,6-dimethylmorpholine-4-carbonyl)pyrrolidin-2-one
CID 6471738

Frequently Asked Questions

What is the IUPAC name of 2-Pyrrolidinone, 4-(morpholinocarbonyl)-1-phenyl-?
The IUPAC name of 2-Pyrrolidinone, 4-(morpholinocarbonyl)-1-phenyl- (CID 217788) is 4-(morpholine-4-carbonyl)-1-phenylpyrrolidin-2-one.
What is the SMILES notation for 2-Pyrrolidinone, 4-(morpholinocarbonyl)-1-phenyl-?
The canonical SMILES for 2-Pyrrolidinone, 4-(morpholinocarbonyl)-1-phenyl- is C1COCCN1C(=O)C2CC(=O)N(C2)C3=CC=CC=C3.
What is the InChIKey of 2-Pyrrolidinone, 4-(morpholinocarbonyl)-1-phenyl-?
The InChIKey is DBZMAKNIJBUOLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3/c18-14-10-12(15(19)16-6-8-20-9-7-16)11-17(14)13-4-2-1-3-5-13/h1-5,12H,6-11H2.
What are the key properties of 2-Pyrrolidinone, 4-(morpholinocarbonyl)-1-phenyl-?
2-Pyrrolidinone, 4-(morpholinocarbonyl)-1-phenyl- has a molecular weight of 274.31 g/mol, XLogP of 0.10, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-Pyrrolidinone, 4-(morpholinocarbonyl)-1-phenyl- is sourced from PubChem (CID 217788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).