2-(3,5-dimethylpyrazol-1-yl)-6-(3-pyrazol-1-ylpiperidin-1-yl)pyrazine

C17H21N7 — CID 133275726

IUPAC2-(3,5-dimethylpyrazol-1-yl)-6-(3-pyrazol-1-ylpiperidin-1-yl)pyrazine
SMILESCc1cc(C)n(-c2cncc(N3CCCC(n4cccn4)C3)n2)n1
InChIInChI=1S/C17H21N7/c1-13-9-14(2)24(21-13)17-11-18-10-16(20-17)22-7-3-5-15(12-22)23-8-4-6-19-23/h4,6,8-11,15H,3,5,7,12H2,1-2H3
InChIKeyTWYAWXSTKOLBPH-UHFFFAOYSA-N
MW323.40 g/mol
LogP2.32
Rot. Bonds3

About 2-(3,5-dimethylpyrazol-1-yl)-6-(3-pyrazol-1-ylpiperidin-1-yl)pyrazine

2-(3,5-dimethylpyrazol-1-yl)-6-(3-pyrazol-1-ylpiperidin-1-yl)pyrazine (PubChem CID 133275726) has the molecular formula C17H21N7 and a molecular weight of 323.40 g/mol. Its IUPAC name is 2-(3,5-dimethylpyrazol-1-yl)-6-(3-pyrazol-1-ylpiperidin-1-yl)pyrazine.

Molecular Properties

Compound Name2-(3,5-dimethylpyrazol-1-yl)-6-(3-pyrazol-1-ylpiperidin-1-yl)pyrazine
PubChem CID133275726
Molecular FormulaC17H21N7
Molecular Weight323.40 g/mol
Exact Mass323.19
IUPAC Name2-(3,5-dimethylpyrazol-1-yl)-6-(3-pyrazol-1-ylpiperidin-1-yl)pyrazine
SMILESCc1cc(C)n(-c2cncc(N3CCCC(n4cccn4)C3)n2)n1
InChIInChI=1S/C17H21N7/c1-13-9-14(2)24(21-13)17-11-18-10-16(20-17)22-7-3-5-15(12-22)23-8-4-6-19-23/h4,6,8-11,15H,3,5,7,12H2,1-2H3
InChIKeyTWYAWXSTKOLBPH-UHFFFAOYSA-N
XLogP2.32
TPSA64.66 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

(3S)-1-[6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]piperidine-3-carboxamide
CID 95768737
2-(3,5-dimethylpyrazol-1-yl)-6-[4-(triazol-1-yl)piperidin-1-yl]pyrazine
CID 133455643
4-[6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]-2-(pyrazol-1-ylmethyl)morpholine
CID 127298016
2-(3,5-dimethylpyrazol-1-yl)-6-(4-methylpiperidin-1-yl)pyrazine
CID 133273860
6-(3,5-dimethylpyrazol-1-yl)-N-methyl-N-(1-pyridazin-3-ylpiperidin-3-yl)pyrazin-2-amine
CID 133281189
2-(3,5-dimethylpyrazol-1-yl)-6-(4-methylpiperazin-1-yl)pyrazine
CID 133273834
1-[6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]-N-(2,2,2-trifluoroethyl)piperidine-3-carboxamide
CID 133331636
[4-(3,5-dimethylpyrazol-1-yl)phenyl]-[(3S)-3-pyrazol-1-ylpiperidin-1-yl]methanone
CID 95158560
[1-[6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]piperidin-4-yl]-(3-methylpiperidin-1-yl)methanone
CID 133283095
2-(3-pyrazol-1-ylpiperidin-1-yl)pyridine
CID 133287338
2-(3,5-dimethylpyrazol-1-yl)-6-(4-ethylpiperazin-1-yl)pyrazine
CID 133273839
2-fluoro-6-(3-pyrazol-1-ylpiperidin-1-yl)pyridine
CID 133275758

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethylpyrazol-1-yl)-6-(3-pyrazol-1-ylpiperidin-1-yl)pyrazine?
The IUPAC name of 2-(3,5-dimethylpyrazol-1-yl)-6-(3-pyrazol-1-ylpiperidin-1-yl)pyrazine (CID 133275726) is 2-(3,5-dimethylpyrazol-1-yl)-6-(3-pyrazol-1-ylpiperidin-1-yl)pyrazine.
What is the SMILES notation for 2-(3,5-dimethylpyrazol-1-yl)-6-(3-pyrazol-1-ylpiperidin-1-yl)pyrazine?
The canonical SMILES for 2-(3,5-dimethylpyrazol-1-yl)-6-(3-pyrazol-1-ylpiperidin-1-yl)pyrazine is Cc1cc(C)n(-c2cncc(N3CCCC(n4cccn4)C3)n2)n1.
What is the InChIKey of 2-(3,5-dimethylpyrazol-1-yl)-6-(3-pyrazol-1-ylpiperidin-1-yl)pyrazine?
The InChIKey is TWYAWXSTKOLBPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N7/c1-13-9-14(2)24(21-13)17-11-18-10-16(20-17)22-7-3-5-15(12-22)23-8-4-6-19-23/h4,6,8-11,15H,3,5,7,12H2,1-2H3.
What are the key properties of 2-(3,5-dimethylpyrazol-1-yl)-6-(3-pyrazol-1-ylpiperidin-1-yl)pyrazine?
2-(3,5-dimethylpyrazol-1-yl)-6-(3-pyrazol-1-ylpiperidin-1-yl)pyrazine has a molecular weight of 323.40 g/mol, XLogP of 2.32, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethylpyrazol-1-yl)-6-(3-pyrazol-1-ylpiperidin-1-yl)pyrazine is sourced from PubChem (CID 133275726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).