(4R)-4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-1-(2-ethyl-6-methylphenyl)pyrrolidin-2-one

C20H24N4O2 — CID 95719384

IUPAC(4R)-4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-1-(2-ethyl-6-methylphenyl)pyrrolidin-2-one
SMILESCCc1cccc(C)c1N1C[C@H](C(=O)N2CCn3cncc3C2)CC1=O
InChIInChI=1S/C20H24N4O2/c1-3-15-6-4-5-14(2)19(15)24-11-16(9-18(24)25)20(26)22-7-8-23-13-21-10-17(23)12-22/h4-6,10,13,16H,3,7-9,11-12H2,1-2H3/t16-/m1/s1
InChIKeyILQHAORTMLWFDL-MRXNPFEDSA-N
MW352.44 g/mol
LogP2.15
Rot. Bonds3

About (4R)-4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-1-(2-ethyl-6-methylphenyl)pyrrolidin-2-one

(4R)-4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-1-(2-ethyl-6-methylphenyl)pyrrolidin-2-one (PubChem CID 95719384) has the molecular formula C20H24N4O2 and a molecular weight of 352.44 g/mol. Its IUPAC name is (4R)-4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-1-(2-ethyl-6-methylphenyl)pyrrolidin-2-one.

Molecular Properties

Compound Name(4R)-4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-1-(2-ethyl-6-methylphenyl)pyrrolidin-2-one
PubChem CID95719384
Molecular FormulaC20H24N4O2
Molecular Weight352.44 g/mol
Exact Mass352.19
IUPAC Name(4R)-4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-1-(2-ethyl-6-methylphenyl)pyrrolidin-2-one
SMILESCCc1cccc(C)c1N1C[C@H](C(=O)N2CCn3cncc3C2)CC1=O
InChIInChI=1S/C20H24N4O2/c1-3-15-6-4-5-14(2)19(15)24-11-16(9-18(24)25)20(26)22-7-8-23-13-21-10-17(23)12-22/h4-6,10,13,16H,3,7-9,11-12H2,1-2H3/t16-/m1/s1
InChIKeyILQHAORTMLWFDL-MRXNPFEDSA-N
XLogP2.15
TPSA58.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.44
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-1-(2-ethyl-6-methylphenyl)pyrrolidin-2-one
CID 56894919
1-(2-ethyl-6-methylphenyl)-4-(4-methylpiperazine-1-carbonyl)pyrrolidin-2-one
CID 113186377
4-(azepane-1-carbonyl)-1-(2-ethyl-6-methylphenyl)pyrrolidin-2-one
CID 113186430
1-(2-ethyl-6-methylphenyl)-4-(2-methyl-2,3-dihydroindole-1-carbonyl)pyrrolidin-2-one
CID 113186494
(3S)-1-(2-ethyl-6-methylphenyl)-5-oxo-N-(pyridin-3-ylmethyl)pyrrolidine-3-carboxamide
CID 29183622
4-[3-(4-chlorophenyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carbonyl]-1-(2-ethyl-6-methylphenyl)pyrrolidin-2-one
CID 108750214
(4S)-1-(2-ethylphenyl)-4-[4-(2-methylphenyl)piperazine-1-carbonyl]pyrrolidin-2-one
CID 9152431
1-(2,6-dimethylphenyl)-4-(4-phenylpiperazine-1-carbonyl)pyrrolidin-2-one
CID 113186228
N-(2,6-dichlorophenyl)-1-(2-ethyl-6-methylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 113186499
N-cyclohexyl-1-(2-ethyl-6-methylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 113186367
1-(2,6-dimethylphenyl)-4-[4-(furan-2-carbonyl)piperazine-1-carbonyl]pyrrolidin-2-one
CID 113186240
1-(2-ethyl-6-methylphenyl)-N-(2-fluorophenyl)-5-oxopyrrolidine-3-carboxamide
CID 113186454

Frequently Asked Questions

What is the IUPAC name of (4R)-4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-1-(2-ethyl-6-methylphenyl)pyrrolidin-2-one?
The IUPAC name of (4R)-4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-1-(2-ethyl-6-methylphenyl)pyrrolidin-2-one (CID 95719384) is (4R)-4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-1-(2-ethyl-6-methylphenyl)pyrrolidin-2-one.
What is the SMILES notation for (4R)-4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-1-(2-ethyl-6-methylphenyl)pyrrolidin-2-one?
The canonical SMILES for (4R)-4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-1-(2-ethyl-6-methylphenyl)pyrrolidin-2-one is CCc1cccc(C)c1N1C[C@H](C(=O)N2CCn3cncc3C2)CC1=O.
What is the InChIKey of (4R)-4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-1-(2-ethyl-6-methylphenyl)pyrrolidin-2-one?
The InChIKey is ILQHAORTMLWFDL-MRXNPFEDSA-N. The full InChI is InChI=1S/C20H24N4O2/c1-3-15-6-4-5-14(2)19(15)24-11-16(9-18(24)25)20(26)22-7-8-23-13-21-10-17(23)12-22/h4-6,10,13,16H,3,7-9,11-12H2,1-2H3/t16-/m1/s1.
What are the key properties of (4R)-4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-1-(2-ethyl-6-methylphenyl)pyrrolidin-2-one?
(4R)-4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-1-(2-ethyl-6-methylphenyl)pyrrolidin-2-one has a molecular weight of 352.44 g/mol, XLogP of 2.15, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-(6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carbonyl)-1-(2-ethyl-6-methylphenyl)pyrrolidin-2-one is sourced from PubChem (CID 95719384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).