2,6-bis(4-chloropyrazol-1-yl)pyrazine

C10H6Cl2N6 — CID 102400986

IUPAC2,6-bis(4-chloropyrazol-1-yl)pyrazine
SMILESClc1cnn(-c2cncc(-n3cc(Cl)cn3)n2)c1
InChIInChI=1S/C10H6Cl2N6/c11-7-1-14-17(5-7)9-3-13-4-10(16-9)18-6-8(12)2-15-18/h1-6H
InChIKeyDCDDZNQSVPCNFC-UHFFFAOYSA-N
MW281.11 g/mol
LogP2.15
Rot. Bonds2

About 2,6-bis(4-chloropyrazol-1-yl)pyrazine

2,6-bis(4-chloropyrazol-1-yl)pyrazine (PubChem CID 102400986) has the molecular formula C10H6Cl2N6 and a molecular weight of 281.11 g/mol. Its IUPAC name is 2,6-bis(4-chloropyrazol-1-yl)pyrazine.

Molecular Properties

Compound Name2,6-bis(4-chloropyrazol-1-yl)pyrazine
PubChem CID102400986
Molecular FormulaC10H6Cl2N6
Molecular Weight281.11 g/mol
Exact Mass280.00
IUPAC Name2,6-bis(4-chloropyrazol-1-yl)pyrazine
SMILESClc1cnn(-c2cncc(-n3cc(Cl)cn3)n2)c1
InChIInChI=1S/C10H6Cl2N6/c11-7-1-14-17(5-7)9-3-13-4-10(16-9)18-6-8(12)2-15-18/h1-6H
InChIKeyDCDDZNQSVPCNFC-UHFFFAOYSA-N
XLogP2.15
TPSA61.42 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.11
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2,6-Bis(1-pyrazolyl)pyrazine
CID 1487780
5-Chloro-2,6-di(pyrazol-1-yl)pyrimidin-4-amine
CID 53467826
2-chloro-6-(1H-pyrazol-1-yl)pyrazine
CID 10035227
2-(4-bromo-1H-pyrazol-1-yl)-5-chloropyrazine
CID 118625836
2-(1H-pyrazol-1-yl)pyrazine
CID 14387154
2-Azido-3-pyrazol-1-ylpyrazine
CID 126484510
5-Chloro-2-[[2-(4-chloropyrazol-1-yl)-4-(trifluoromethyl)imidazol-1-yl]methyl]pyrimidine
CID 170633040
5-Chloro-2-[[2-(4-fluoropyrazol-1-yl)-4-(trifluoromethyl)imidazol-1-yl]methyl]pyrimidine
CID 176842788
2-Chloro-6-[4-(trifluoromethyl)pyrazol-1-yl]pyrazine
CID 64177101
2-Chloro-3-[4-(trifluoromethyl)pyrazol-1-yl]pyrazine
CID 64178973
2-Chloro-5-(1H-pyrazol-1-yl)pyrazine
CID 54002050
2-(4-iodo-1H-pyrazol-1-yl)pyrazine
CID 64431209

Frequently Asked Questions

What is the IUPAC name of 2,6-bis(4-chloropyrazol-1-yl)pyrazine?
The IUPAC name of 2,6-bis(4-chloropyrazol-1-yl)pyrazine (CID 102400986) is 2,6-bis(4-chloropyrazol-1-yl)pyrazine.
What is the SMILES notation for 2,6-bis(4-chloropyrazol-1-yl)pyrazine?
The canonical SMILES for 2,6-bis(4-chloropyrazol-1-yl)pyrazine is Clc1cnn(-c2cncc(-n3cc(Cl)cn3)n2)c1.
What is the InChIKey of 2,6-bis(4-chloropyrazol-1-yl)pyrazine?
The InChIKey is DCDDZNQSVPCNFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6Cl2N6/c11-7-1-14-17(5-7)9-3-13-4-10(16-9)18-6-8(12)2-15-18/h1-6H.
What are the key properties of 2,6-bis(4-chloropyrazol-1-yl)pyrazine?
2,6-bis(4-chloropyrazol-1-yl)pyrazine has a molecular weight of 281.11 g/mol, XLogP of 2.15, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-bis(4-chloropyrazol-1-yl)pyrazine is sourced from PubChem (CID 102400986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).