[4-(6-chloropyrazin-2-yl)piperazin-1-yl]-(furan-2-yl)methanone

C13H13ClN4O2 — CID 47137505

IUPAC[4-(6-chloropyrazin-2-yl)piperazin-1-yl]-(furan-2-yl)methanone
SMILESO=C(c1ccco1)N1CCN(c2cncc(Cl)n2)CC1
InChIInChI=1S/C13H13ClN4O2/c14-11-8-15-9-12(16-11)17-3-5-18(6-4-17)13(19)10-2-1-7-20-10/h1-2,7-9H,3-6H2
InChIKeyZBLBHXQVJLSZLS-UHFFFAOYSA-N
MW292.73 g/mol
LogP1.69
Rot. Bonds2

About [4-(6-chloropyrazin-2-yl)piperazin-1-yl]-(furan-2-yl)methanone

[4-(6-chloropyrazin-2-yl)piperazin-1-yl]-(furan-2-yl)methanone (PubChem CID 47137505) has the molecular formula C13H13ClN4O2 and a molecular weight of 292.73 g/mol. Its IUPAC name is [4-(6-chloropyrazin-2-yl)piperazin-1-yl]-(furan-2-yl)methanone.

Molecular Properties

Compound Name[4-(6-chloropyrazin-2-yl)piperazin-1-yl]-(furan-2-yl)methanone
PubChem CID47137505
Molecular FormulaC13H13ClN4O2
Molecular Weight292.73 g/mol
Exact Mass292.07
IUPAC Name[4-(6-chloropyrazin-2-yl)piperazin-1-yl]-(furan-2-yl)methanone
SMILESO=C(c1ccco1)N1CCN(c2cncc(Cl)n2)CC1
InChIInChI=1S/C13H13ClN4O2/c14-11-8-15-9-12(16-11)17-3-5-18(6-4-17)13(19)10-2-1-7-20-10/h1-2,7-9H,3-6H2
InChIKeyZBLBHXQVJLSZLS-UHFFFAOYSA-N
XLogP1.69
TPSA62.47 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.73
LogP ≤ 51.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

furan-2-yl-[4-(6-methoxypyrazin-2-yl)piperazin-1-yl]methanone
CID 171690760
[4-[6-(azepan-1-yl)pyridazin-3-yl]piperazin-1-yl]-(furan-2-yl)methanone
CID 7292456
furan-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone
CID 759046
furan-2-yl-[4-(2-methylpyrimidin-4-yl)piperazin-1-yl]methanone
CID 171130326
[4-(3-chloro-2-pyridinyl)piperazin-1-yl]-(furan-2-yl)methanone
CID 47129924
[4-(2,6-diaminopyrimidin-4-yl)piperazin-1-yl]-(furan-2-yl)methanone
CID 14156152
[6-[4-(furan-2-carbonyl)piperazin-1-yl]-3-pyridinyl]-morpholin-4-ylmethanone
CID 109153468
[4-(5-chloropyrimidin-2-yl)-1,4-diazepan-1-yl]-(furan-2-yl)methanone
CID 86778300
furan-2-yl-[4-[5-(4-methylpiperazine-1-carbonyl)-3-pyridinyl]piperazin-1-yl]methanone
CID 109230109
[4-(3-chlorophenyl)piperazin-1-yl]-(furan-2-yl)methanone
CID 669410
[4-[5-(azepan-1-yl)pyridine-3-carbonyl]piperazin-1-yl]-(furan-2-yl)methanone
CID 109238559
furan-2-yl-[4-(5-morpholin-4-ylpyridazin-3-yl)piperazin-1-yl]methanone
CID 91968843

Frequently Asked Questions

What is the IUPAC name of [4-(6-chloropyrazin-2-yl)piperazin-1-yl]-(furan-2-yl)methanone?
The IUPAC name of [4-(6-chloropyrazin-2-yl)piperazin-1-yl]-(furan-2-yl)methanone (CID 47137505) is [4-(6-chloropyrazin-2-yl)piperazin-1-yl]-(furan-2-yl)methanone.
What is the SMILES notation for [4-(6-chloropyrazin-2-yl)piperazin-1-yl]-(furan-2-yl)methanone?
The canonical SMILES for [4-(6-chloropyrazin-2-yl)piperazin-1-yl]-(furan-2-yl)methanone is O=C(c1ccco1)N1CCN(c2cncc(Cl)n2)CC1.
What is the InChIKey of [4-(6-chloropyrazin-2-yl)piperazin-1-yl]-(furan-2-yl)methanone?
The InChIKey is ZBLBHXQVJLSZLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13ClN4O2/c14-11-8-15-9-12(16-11)17-3-5-18(6-4-17)13(19)10-2-1-7-20-10/h1-2,7-9H,3-6H2.
What are the key properties of [4-(6-chloropyrazin-2-yl)piperazin-1-yl]-(furan-2-yl)methanone?
[4-(6-chloropyrazin-2-yl)piperazin-1-yl]-(furan-2-yl)methanone has a molecular weight of 292.73 g/mol, XLogP of 1.69, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(6-chloropyrazin-2-yl)piperazin-1-yl]-(furan-2-yl)methanone is sourced from PubChem (CID 47137505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).