(6-chloropyrazin-2-yl)-piperazin-1-ylmethanone;hydrochloride

C9H12Cl2N4O — CID 118279345

IUPAC(6-chloropyrazin-2-yl)-piperazin-1-ylmethanone;hydrochloride
SMILESCl.O=C(c1cncc(Cl)n1)N1CCNCC1
InChIInChI=1S/C9H11ClN4O.ClH/c10-8-6-12-5-7(13-8)9(15)14-3-1-11-2-4-14;/h5-6,11H,1-4H2;1H
InChIKeyRKUWURVKJJAEGX-UHFFFAOYSA-N
MW263.13 g/mol
LogP0.60
Rot. Bonds1

About (6-chloropyrazin-2-yl)-piperazin-1-ylmethanone;hydrochloride

(6-chloropyrazin-2-yl)-piperazin-1-ylmethanone;hydrochloride (PubChem CID 118279345) has the molecular formula C9H12Cl2N4O and a molecular weight of 263.13 g/mol. Its IUPAC name is (6-chloropyrazin-2-yl)-piperazin-1-ylmethanone;hydrochloride.

Molecular Properties

Compound Name(6-chloropyrazin-2-yl)-piperazin-1-ylmethanone;hydrochloride
PubChem CID118279345
Molecular FormulaC9H12Cl2N4O
Molecular Weight263.13 g/mol
Exact Mass262.04
IUPAC Name(6-chloropyrazin-2-yl)-piperazin-1-ylmethanone;hydrochloride
SMILESCl.O=C(c1cncc(Cl)n1)N1CCNCC1
InChIInChI=1S/C9H11ClN4O.ClH/c10-8-6-12-5-7(13-8)9(15)14-3-1-11-2-4-14;/h5-6,11H,1-4H2;1H
InChIKeyRKUWURVKJJAEGX-UHFFFAOYSA-N
XLogP0.60
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.13
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (6-chloropyrazin-2-yl)-piperazin-1-ylmethanone;hydrochloride 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

1-[4-(6-chloropyrazine-2-carbonyl)piperazin-1-yl]ethanone
CID 103186798
(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)-(4-methylsulfonylpiperazin-1-yl)methanone
CID 106550918
(6-chloropyrazin-2-yl)-(1,4-oxazepan-4-yl)methanone
CID 106551253
(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)-(3,3-difluoroazetidin-1-yl)methanone
CID 146001430
(6-chloropyrazin-2-yl)-(4-prop-2-ynylpiperazin-1-yl)methanone
CID 106551233
(3-chloro-4-pyridinyl)-piperazin-1-ylmethanone;dihydrochloride
CID 119402073
N-[1-(6-chloropyrazine-2-carbonyl)piperidin-4-yl]methanesulfonamide
CID 106550944

Frequently Asked Questions

What is the IUPAC name of (6-chloropyrazin-2-yl)-piperazin-1-ylmethanone;hydrochloride?
The IUPAC name of (6-chloropyrazin-2-yl)-piperazin-1-ylmethanone;hydrochloride (CID 118279345) is (6-chloropyrazin-2-yl)-piperazin-1-ylmethanone;hydrochloride.
What is the SMILES notation for (6-chloropyrazin-2-yl)-piperazin-1-ylmethanone;hydrochloride?
The canonical SMILES for (6-chloropyrazin-2-yl)-piperazin-1-ylmethanone;hydrochloride is Cl.O=C(c1cncc(Cl)n1)N1CCNCC1.
What is the InChIKey of (6-chloropyrazin-2-yl)-piperazin-1-ylmethanone;hydrochloride?
The InChIKey is RKUWURVKJJAEGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11ClN4O.ClH/c10-8-6-12-5-7(13-8)9(15)14-3-1-11-2-4-14;/h5-6,11H,1-4H2;1H.
What are the key properties of (6-chloropyrazin-2-yl)-piperazin-1-ylmethanone;hydrochloride?
(6-chloropyrazin-2-yl)-piperazin-1-ylmethanone;hydrochloride has a molecular weight of 263.13 g/mol, XLogP of 0.60, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6-chloropyrazin-2-yl)-piperazin-1-ylmethanone;hydrochloride is sourced from PubChem (CID 118279345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).