(5-chloropyrazin-2-yl)-(2-ethylpyrrolidin-1-yl)methanone

C11H14ClN3O — CID 107257609

IUPAC(5-chloropyrazin-2-yl)-(2-ethylpyrrolidin-1-yl)methanone
SMILESCCC1CCCN1C(=O)c1cnc(Cl)cn1
InChIInChI=1S/C11H14ClN3O/c1-2-8-4-3-5-15(8)11(16)9-6-14-10(12)7-13-9/h6-8H,2-5H2,1H3
InChIKeyVHBXEMWCUROIBQ-UHFFFAOYSA-N
MW239.71 g/mol
LogP2.14
Rot. Bonds2

About (5-chloropyrazin-2-yl)-(2-ethylpyrrolidin-1-yl)methanone

(5-chloropyrazin-2-yl)-(2-ethylpyrrolidin-1-yl)methanone (PubChem CID 107257609) has the molecular formula C11H14ClN3O and a molecular weight of 239.71 g/mol. Its IUPAC name is (5-chloropyrazin-2-yl)-(2-ethylpyrrolidin-1-yl)methanone.

Molecular Properties

Compound Name(5-chloropyrazin-2-yl)-(2-ethylpyrrolidin-1-yl)methanone
PubChem CID107257609
Molecular FormulaC11H14ClN3O
Molecular Weight239.71 g/mol
Exact Mass239.08
IUPAC Name(5-chloropyrazin-2-yl)-(2-ethylpyrrolidin-1-yl)methanone
SMILESCCC1CCCN1C(=O)c1cnc(Cl)cn1
InChIInChI=1S/C11H14ClN3O/c1-2-8-4-3-5-15(8)11(16)9-6-14-10(12)7-13-9/h6-8H,2-5H2,1H3
InChIKeyVHBXEMWCUROIBQ-UHFFFAOYSA-N
XLogP2.14
TPSA46.09 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.71
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze (5-chloropyrazin-2-yl)-(2-ethylpyrrolidin-1-yl)methanone 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

2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl-(5-chloropyrazin-2-yl)methanone
CID 107257889
(2-ethylpiperidin-1-yl)-(5-hydrazinylpyrazin-2-yl)methanone
CID 107378063
[5-(2-chloroanilino)pyrazin-2-yl]-(2-ethylpiperidin-1-yl)methanone
CID 109288522
(2-chloro-4-pyridinyl)-(2-ethylpyrrolidin-1-yl)methanone
CID 60974569
5-(2-ethylpyrrolidine-1-carbonyl)pyridine-2-carboxylic acid
CID 54885795
(2-ethylpiperidin-1-yl)-(5-morpholin-4-ylpyrazin-2-yl)methanone
CID 109276634
(2-ethylpiperidin-1-yl)-[5-(N-methylanilino)pyrazin-2-yl]methanone
CID 109288501
[5-(2-chloro-4,6-dimethylanilino)pyrazin-2-yl]-(2-ethylpiperidin-1-yl)methanone
CID 109288530
(2-ethylpiperidin-1-yl)-[5-(2-methoxyethylamino)pyrazin-2-yl]methanone
CID 109275908
(5-chloropyrazin-2-yl)-[4-(diethylamino)piperidin-1-yl]methanone
CID 107257837
[2-(3-hydroxypropyl)pyrrolidin-1-yl]-(5-methylpyrazin-2-yl)methanone
CID 62466811
[2-(hydroxymethyl)pyrrolidin-1-yl]-[5-(methylamino)pyrazin-2-yl]methanone
CID 107375092

Frequently Asked Questions

What is the IUPAC name of (5-chloropyrazin-2-yl)-(2-ethylpyrrolidin-1-yl)methanone?
The IUPAC name of (5-chloropyrazin-2-yl)-(2-ethylpyrrolidin-1-yl)methanone (CID 107257609) is (5-chloropyrazin-2-yl)-(2-ethylpyrrolidin-1-yl)methanone.
What is the SMILES notation for (5-chloropyrazin-2-yl)-(2-ethylpyrrolidin-1-yl)methanone?
The canonical SMILES for (5-chloropyrazin-2-yl)-(2-ethylpyrrolidin-1-yl)methanone is CCC1CCCN1C(=O)c1cnc(Cl)cn1.
What is the InChIKey of (5-chloropyrazin-2-yl)-(2-ethylpyrrolidin-1-yl)methanone?
The InChIKey is VHBXEMWCUROIBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClN3O/c1-2-8-4-3-5-15(8)11(16)9-6-14-10(12)7-13-9/h6-8H,2-5H2,1H3.
What are the key properties of (5-chloropyrazin-2-yl)-(2-ethylpyrrolidin-1-yl)methanone?
(5-chloropyrazin-2-yl)-(2-ethylpyrrolidin-1-yl)methanone has a molecular weight of 239.71 g/mol, XLogP of 2.14, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chloropyrazin-2-yl)-(2-ethylpyrrolidin-1-yl)methanone is sourced from PubChem (CID 107257609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).