(4R)-1-(4-ethylphenyl)-4-(morpholine-4-carbonyl)pyrrolidin-2-one

C17H22N2O3 — CID 9389112

IUPAC(4R)-1-(4-ethylphenyl)-4-(morpholine-4-carbonyl)pyrrolidin-2-one
SMILESCCc1ccc(N2C[C@H](C(=O)N3CCOCC3)CC2=O)cc1
InChIInChI=1S/C17H22N2O3/c1-2-13-3-5-15(6-4-13)19-12-14(11-16(19)20)17(21)18-7-9-22-10-8-18/h3-6,14H,2,7-12H2,1H3/t14-/m1/s1
InChIKeyFWOQHVJFCCHCPG-CQSZACIVSA-N
MW302.37 g/mol
LogP1.46
Rot. Bonds3

About (4R)-1-(4-ethylphenyl)-4-(morpholine-4-carbonyl)pyrrolidin-2-one

(4R)-1-(4-ethylphenyl)-4-(morpholine-4-carbonyl)pyrrolidin-2-one (PubChem CID 9389112) has the molecular formula C17H22N2O3 and a molecular weight of 302.37 g/mol. Its IUPAC name is (4R)-1-(4-ethylphenyl)-4-(morpholine-4-carbonyl)pyrrolidin-2-one.

Molecular Properties

Compound Name(4R)-1-(4-ethylphenyl)-4-(morpholine-4-carbonyl)pyrrolidin-2-one
PubChem CID9389112
Molecular FormulaC17H22N2O3
Molecular Weight302.37 g/mol
Exact Mass302.16
IUPAC Name(4R)-1-(4-ethylphenyl)-4-(morpholine-4-carbonyl)pyrrolidin-2-one
SMILESCCc1ccc(N2C[C@H](C(=O)N3CCOCC3)CC2=O)cc1
InChIInChI=1S/C17H22N2O3/c1-2-13-3-5-15(6-4-13)19-12-14(11-16(19)20)17(21)18-7-9-22-10-8-18/h3-6,14H,2,7-12H2,1H3/t14-/m1/s1
InChIKeyFWOQHVJFCCHCPG-CQSZACIVSA-N
XLogP1.46
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.37
LogP ≤ 51.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(4R)-1-(4-bromophenyl)-4-(morpholine-4-carbonyl)pyrrolidin-2-one
CID 40979269
4-[4-(1-aminoethyl)piperidine-1-carbonyl]-1-(4-ethylphenyl)pyrrolidin-2-one;hydrochloride
CID 119518509
1-(4-butylphenyl)-4-[3-(morpholine-4-carbonyl)piperidine-1-carbonyl]pyrrolidin-2-one
CID 55580326
(4R)-1-(4-ethylphenyl)-4-[4-(furan-2-carbonyl)piperazine-1-carbonyl]pyrrolidin-2-one
CID 9390081
(4R)-4-(4-benzylpiperazine-1-carbonyl)-1-(4-ethylphenyl)pyrrolidin-2-one
CID 9388978
8-[1-(4-ethylphenyl)-5-oxopyrrolidine-3-carbonyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione
CID 55472622
1-(4-ethylphenyl)-4-[4-(methylaminomethyl)piperidine-1-carbonyl]pyrrolidin-2-one;hydrochloride
CID 119544467
1-[1-(4-ethylphenyl)-5-oxopyrrolidine-3-carbonyl]piperidine-3-carboxylic acid
CID 45340293
(4S)-4-(1,4-oxazepane-4-carbonyl)-1-(4-propan-2-ylphenyl)pyrrolidin-2-one
CID 97149949
1-(4-ethylphenyl)-4-[4-(3-methylphenyl)piperazine-1-carbonyl]pyrrolidin-2-one
CID 43034872
(3R)-1-(4-ethylphenyl)-5-oxopyrrolidine-3-carboxylate
CID 6922046
(4S)-1-(1,3-benzodioxol-5-yl)-4-(morpholine-4-carbonyl)pyrrolidin-2-one
CID 31857788

Frequently Asked Questions

What is the IUPAC name of (4R)-1-(4-ethylphenyl)-4-(morpholine-4-carbonyl)pyrrolidin-2-one?
The IUPAC name of (4R)-1-(4-ethylphenyl)-4-(morpholine-4-carbonyl)pyrrolidin-2-one (CID 9389112) is (4R)-1-(4-ethylphenyl)-4-(morpholine-4-carbonyl)pyrrolidin-2-one.
What is the SMILES notation for (4R)-1-(4-ethylphenyl)-4-(morpholine-4-carbonyl)pyrrolidin-2-one?
The canonical SMILES for (4R)-1-(4-ethylphenyl)-4-(morpholine-4-carbonyl)pyrrolidin-2-one is CCc1ccc(N2C[C@H](C(=O)N3CCOCC3)CC2=O)cc1.
What is the InChIKey of (4R)-1-(4-ethylphenyl)-4-(morpholine-4-carbonyl)pyrrolidin-2-one?
The InChIKey is FWOQHVJFCCHCPG-CQSZACIVSA-N. The full InChI is InChI=1S/C17H22N2O3/c1-2-13-3-5-15(6-4-13)19-12-14(11-16(19)20)17(21)18-7-9-22-10-8-18/h3-6,14H,2,7-12H2,1H3/t14-/m1/s1.
What are the key properties of (4R)-1-(4-ethylphenyl)-4-(morpholine-4-carbonyl)pyrrolidin-2-one?
(4R)-1-(4-ethylphenyl)-4-(morpholine-4-carbonyl)pyrrolidin-2-one has a molecular weight of 302.37 g/mol, XLogP of 1.46, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-1-(4-ethylphenyl)-4-(morpholine-4-carbonyl)pyrrolidin-2-one is sourced from PubChem (CID 9389112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).