1-cyclopropyl-3-(1-ethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbonyl)-4-methylpyridin-2-one

C19H23N3O2 — CID 172669006

IUPAC1-cyclopropyl-3-(1-ethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbonyl)-4-methylpyridin-2-one
SMILESCCC1c2cccn2CCN1C(=O)c1c(C)ccn(C2CC2)c1=O
InChIInChI=1S/C19H23N3O2/c1-3-15-16-5-4-9-20(16)11-12-22(15)19(24)17-13(2)8-10-21(18(17)23)14-6-7-14/h4-5,8-10,14-15H,3,6-7,11-12H2,1-2H3
InChIKeyRZNBVJHMZPCELS-UHFFFAOYSA-N
MW325.41 g/mol
LogP2.90
Rot. Bonds3

About 1-cyclopropyl-3-(1-ethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbonyl)-4-methylpyridin-2-one

1-cyclopropyl-3-(1-ethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbonyl)-4-methylpyridin-2-one (PubChem CID 172669006) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is 1-cyclopropyl-3-(1-ethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbonyl)-4-methylpyridin-2-one.

Molecular Properties

Compound Name1-cyclopropyl-3-(1-ethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbonyl)-4-methylpyridin-2-one
PubChem CID172669006
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC Name1-cyclopropyl-3-(1-ethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbonyl)-4-methylpyridin-2-one
SMILESCCC1c2cccn2CCN1C(=O)c1c(C)ccn(C2CC2)c1=O
InChIInChI=1S/C19H23N3O2/c1-3-15-16-5-4-9-20(16)11-12-22(15)19(24)17-13(2)8-10-21(18(17)23)14-6-7-14/h4-5,8-10,14-15H,3,6-7,11-12H2,1-2H3
InChIKeyRZNBVJHMZPCELS-UHFFFAOYSA-N
XLogP2.90
TPSA47.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

[(1S)-1-ethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]-(5-hydroxy-1,2-dimethylindol-3-yl)methanone
CID 95889426
1-cyclopropyl-4-methyl-3-(2-propan-2-yl-2,5-dihydropyrrole-1-carbonyl)pyridin-2-one
CID 172671068
1,3-benzodioxol-5-yl-(1-ethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone
CID 70754766
[(1S)-1-ethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]-(5-methoxy-1-methylindol-2-yl)methanone
CID 97156148
[(1R)-1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]-(2-methylphenyl)methanone
CID 37452067
[(1R)-1-ethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]-[3-(2-hydroxyphenyl)-1H-pyrazol-5-yl]methanone
CID 136890699
(2-methylphenyl)-[1-(2-methylphenyl)-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]methanone
CID 24859416
1-cyclopropyl-4-methyl-3-[2-(4-methyl-1H-benzimidazol-2-yl)pyrrolidine-1-carbonyl]pyridin-2-one
CID 175645173
[(1R)-1-ethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]-(2-thiophen-2-yl-1,3-thiazol-4-yl)methanone
CID 96578460
4-(1-ethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbonyl)-N-prop-2-enylbenzenesulfonamide
CID 75429902
[(1R)-1-ethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]-(3-pyridin-2-yl-1H-pyrazol-5-yl)methanone
CID 51495389
3-[3-(1H-benzimidazol-2-ylmethyl)piperidine-1-carbonyl]-1-cyclopropyl-4-methylpyridin-2-one
CID 172666091

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-(1-ethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbonyl)-4-methylpyridin-2-one?
The IUPAC name of 1-cyclopropyl-3-(1-ethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbonyl)-4-methylpyridin-2-one (CID 172669006) is 1-cyclopropyl-3-(1-ethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbonyl)-4-methylpyridin-2-one.
What is the SMILES notation for 1-cyclopropyl-3-(1-ethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbonyl)-4-methylpyridin-2-one?
The canonical SMILES for 1-cyclopropyl-3-(1-ethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbonyl)-4-methylpyridin-2-one is CCC1c2cccn2CCN1C(=O)c1c(C)ccn(C2CC2)c1=O.
What is the InChIKey of 1-cyclopropyl-3-(1-ethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbonyl)-4-methylpyridin-2-one?
The InChIKey is RZNBVJHMZPCELS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-3-15-16-5-4-9-20(16)11-12-22(15)19(24)17-13(2)8-10-21(18(17)23)14-6-7-14/h4-5,8-10,14-15H,3,6-7,11-12H2,1-2H3.
What are the key properties of 1-cyclopropyl-3-(1-ethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbonyl)-4-methylpyridin-2-one?
1-cyclopropyl-3-(1-ethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbonyl)-4-methylpyridin-2-one has a molecular weight of 325.41 g/mol, XLogP of 2.90, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-(1-ethyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbonyl)-4-methylpyridin-2-one is sourced from PubChem (CID 172669006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).