(5-chloropyrazin-2-yl)-[4-(2-hydroxyethyl)piperazin-1-yl]methanone

C11H15ClN4O2 — CID 103817134

IUPAC(5-chloropyrazin-2-yl)-[4-(2-hydroxyethyl)piperazin-1-yl]methanone
SMILESO=C(c1cnc(Cl)cn1)N1CCN(CCO)CC1
InChIInChI=1S/C11H15ClN4O2/c12-10-8-13-9(7-14-10)11(18)16-3-1-15(2-4-16)5-6-17/h7-8,17H,1-6H2
InChIKeyVMHXGJOQFDNOIC-UHFFFAOYSA-N
MW270.72 g/mol
LogP-0.12
Rot. Bonds3

About (5-chloropyrazin-2-yl)-[4-(2-hydroxyethyl)piperazin-1-yl]methanone

(5-chloropyrazin-2-yl)-[4-(2-hydroxyethyl)piperazin-1-yl]methanone (PubChem CID 103817134) has the molecular formula C11H15ClN4O2 and a molecular weight of 270.72 g/mol. Its IUPAC name is (5-chloropyrazin-2-yl)-[4-(2-hydroxyethyl)piperazin-1-yl]methanone.

Molecular Properties

Compound Name(5-chloropyrazin-2-yl)-[4-(2-hydroxyethyl)piperazin-1-yl]methanone
PubChem CID103817134
Molecular FormulaC11H15ClN4O2
Molecular Weight270.72 g/mol
Exact Mass270.09
IUPAC Name(5-chloropyrazin-2-yl)-[4-(2-hydroxyethyl)piperazin-1-yl]methanone
SMILESO=C(c1cnc(Cl)cn1)N1CCN(CCO)CC1
InChIInChI=1S/C11H15ClN4O2/c12-10-8-13-9(7-14-10)11(18)16-3-1-15(2-4-16)5-6-17/h7-8,17H,1-6H2
InChIKeyVMHXGJOQFDNOIC-UHFFFAOYSA-N
XLogP-0.12
TPSA69.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.72
LogP ≤ 5-0.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[4-(5-chloropyrazine-2-carbonyl)piperazin-1-yl]ethanone
CID 103803140
[4-(2-hydroxyethyl)piperazin-1-yl]-(2H-triazol-4-yl)methanone
CID 110475446
(5-chloropyrazin-2-yl)-[4-[(dimethylamino)methyl]piperidin-1-yl]methanone
CID 107257835
2-[4-(5-chloropyrazine-2-carbonyl)piperazin-1-yl]propanoic acid
CID 107371501
(5-chloropyrazin-2-yl)-[4-(diethylamino)piperidin-1-yl]methanone
CID 107257837
(5-chloropyrazin-2-yl)-(3,5-dimethylpiperidin-1-yl)methanone
CID 103803161
(5-chloropyrazin-2-yl)-(4-pyrazin-2-ylpiperazin-1-yl)methanone
CID 107244924
(5-chloropyrazin-2-yl)-[4-(methoxymethyl)piperidin-1-yl]methanone
CID 113268061
5-chloro-N-[2-(4-methylpiperazin-1-yl)ethyl]pyrazine-2-carboxamide
CID 107371808
(5-aminopyrazin-2-yl)-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]methanone
CID 107375502
[4-(2-hydroxyethyl)piperazin-1-yl]-(thiadiazol-4-yl)methanone
CID 61067356
(5-chloropyrazin-2-yl)-[4-(diethylaminomethyl)piperidin-1-yl]methanone
CID 107257834

Frequently Asked Questions

What is the IUPAC name of (5-chloropyrazin-2-yl)-[4-(2-hydroxyethyl)piperazin-1-yl]methanone?
The IUPAC name of (5-chloropyrazin-2-yl)-[4-(2-hydroxyethyl)piperazin-1-yl]methanone (CID 103817134) is (5-chloropyrazin-2-yl)-[4-(2-hydroxyethyl)piperazin-1-yl]methanone.
What is the SMILES notation for (5-chloropyrazin-2-yl)-[4-(2-hydroxyethyl)piperazin-1-yl]methanone?
The canonical SMILES for (5-chloropyrazin-2-yl)-[4-(2-hydroxyethyl)piperazin-1-yl]methanone is O=C(c1cnc(Cl)cn1)N1CCN(CCO)CC1.
What is the InChIKey of (5-chloropyrazin-2-yl)-[4-(2-hydroxyethyl)piperazin-1-yl]methanone?
The InChIKey is VMHXGJOQFDNOIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN4O2/c12-10-8-13-9(7-14-10)11(18)16-3-1-15(2-4-16)5-6-17/h7-8,17H,1-6H2.
What are the key properties of (5-chloropyrazin-2-yl)-[4-(2-hydroxyethyl)piperazin-1-yl]methanone?
(5-chloropyrazin-2-yl)-[4-(2-hydroxyethyl)piperazin-1-yl]methanone has a molecular weight of 270.72 g/mol, XLogP of -0.12, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chloropyrazin-2-yl)-[4-(2-hydroxyethyl)piperazin-1-yl]methanone is sourced from PubChem (CID 103817134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).