1-[4-(6-chloropyrazine-2-carbonyl)piperazin-1-yl]ethanone

C11H13ClN4O2 — CID 103186798

IUPAC1-[4-(6-chloropyrazine-2-carbonyl)piperazin-1-yl]ethanone
SMILESCC(=O)N1CCN(C(=O)c2cncc(Cl)n2)CC1
InChIInChI=1S/C11H13ClN4O2/c1-8(17)15-2-4-16(5-3-15)11(18)9-6-13-7-10(12)14-9/h6-7H,2-5H2,1H3
InChIKeyDUKUFKJQRIBTFH-UHFFFAOYSA-N
MW268.70 g/mol
LogP0.43
Rot. Bonds1

About 1-[4-(6-chloropyrazine-2-carbonyl)piperazin-1-yl]ethanone

1-[4-(6-chloropyrazine-2-carbonyl)piperazin-1-yl]ethanone (PubChem CID 103186798) has the molecular formula C11H13ClN4O2 and a molecular weight of 268.70 g/mol. Its IUPAC name is 1-[4-(6-chloropyrazine-2-carbonyl)piperazin-1-yl]ethanone.

Molecular Properties

Compound Name1-[4-(6-chloropyrazine-2-carbonyl)piperazin-1-yl]ethanone
PubChem CID103186798
Molecular FormulaC11H13ClN4O2
Molecular Weight268.70 g/mol
Exact Mass268.07
IUPAC Name1-[4-(6-chloropyrazine-2-carbonyl)piperazin-1-yl]ethanone
SMILESCC(=O)N1CCN(C(=O)c2cncc(Cl)n2)CC1
InChIInChI=1S/C11H13ClN4O2/c1-8(17)15-2-4-16(5-3-15)11(18)9-6-13-7-10(12)14-9/h6-7H,2-5H2,1H3
InChIKeyDUKUFKJQRIBTFH-UHFFFAOYSA-N
XLogP0.43
TPSA66.40 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.70
LogP ≤ 50.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-[4-(6-chloropyrazine-2-carbonyl)piperazin-1-yl]ethanone 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

(6-chloropyrazin-2-yl)-(4-methylsulfonylpiperazin-1-yl)methanone
CID 106550918
(6-chloropyrazin-2-yl)-thiomorpholin-4-ylmethanone
CID 103187110
(6-chloropyrazin-2-yl)-(1,1-dioxo-1,4-thiazinan-4-yl)methanone
CID 103337443
(6-chloropyrazin-2-yl)-piperazin-1-ylmethanone;hydrochloride
CID 118279345
(6-chloropyrazin-2-yl)-(3,5-dimethylpiperidin-1-yl)methanone
CID 103186815
(6-chloropyrazin-2-yl)-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methanone
CID 106550933
(6-chloropyrazin-2-yl)-(4-ethylpiperidin-1-yl)methanone
CID 106551174
(6-chloropyrazin-2-yl)-(4-prop-2-ynylpiperazin-1-yl)methanone
CID 106551233
(6-chloropyrazin-2-yl)-(1,4-oxazepan-4-yl)methanone
CID 106551253
1-[4-(5-chloropyrazine-2-carbonyl)piperazin-1-yl]ethanone
CID 103803140
N-[1-(6-chloropyrazine-2-carbonyl)piperidin-4-yl]methanesulfonamide
CID 106550944
(6-chloropyrazin-2-yl)-(3,3-difluoroazetidin-1-yl)methanone
CID 146001430

Frequently Asked Questions

What is the IUPAC name of 1-[4-(6-chloropyrazine-2-carbonyl)piperazin-1-yl]ethanone?
The IUPAC name of 1-[4-(6-chloropyrazine-2-carbonyl)piperazin-1-yl]ethanone (CID 103186798) is 1-[4-(6-chloropyrazine-2-carbonyl)piperazin-1-yl]ethanone.
What is the SMILES notation for 1-[4-(6-chloropyrazine-2-carbonyl)piperazin-1-yl]ethanone?
The canonical SMILES for 1-[4-(6-chloropyrazine-2-carbonyl)piperazin-1-yl]ethanone is CC(=O)N1CCN(C(=O)c2cncc(Cl)n2)CC1.
What is the InChIKey of 1-[4-(6-chloropyrazine-2-carbonyl)piperazin-1-yl]ethanone?
The InChIKey is DUKUFKJQRIBTFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13ClN4O2/c1-8(17)15-2-4-16(5-3-15)11(18)9-6-13-7-10(12)14-9/h6-7H,2-5H2,1H3.
What are the key properties of 1-[4-(6-chloropyrazine-2-carbonyl)piperazin-1-yl]ethanone?
1-[4-(6-chloropyrazine-2-carbonyl)piperazin-1-yl]ethanone has a molecular weight of 268.70 g/mol, XLogP of 0.43, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(6-chloropyrazine-2-carbonyl)piperazin-1-yl]ethanone is sourced from PubChem (CID 103186798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).