2-[3-[3-(3-methylpyrazin-2-yl)phenyl]pyrazol-1-yl]-N-pyrazin-2-ylacetamide

C20H17N7O — CID 30869523

IUPAC2-[3-[3-(3-methylpyrazin-2-yl)phenyl]pyrazol-1-yl]-N-pyrazin-2-ylacetamide
SMILESCc1nccnc1-c1cccc(-c2ccn(CC(=O)Nc3cnccn3)n2)c1
InChIInChI=1S/C20H17N7O/c1-14-20(24-9-8-22-14)16-4-2-3-15(11-16)17-5-10-27(26-17)13-19(28)25-18-12-21-6-7-23-18/h2-12H,13H2,1H3,(H,23,25,28)
InChIKeyOQHBTXHLPQNHNE-UHFFFAOYSA-N
MW371.40 g/mol
LogP2.74
Rot. Bonds5

About 2-[3-[3-(3-methylpyrazin-2-yl)phenyl]pyrazol-1-yl]-N-pyrazin-2-ylacetamide

2-[3-[3-(3-methylpyrazin-2-yl)phenyl]pyrazol-1-yl]-N-pyrazin-2-ylacetamide (PubChem CID 30869523) has the molecular formula C20H17N7O and a molecular weight of 371.40 g/mol. Its IUPAC name is 2-[3-[3-(3-methylpyrazin-2-yl)phenyl]pyrazol-1-yl]-N-pyrazin-2-ylacetamide.

Molecular Properties

Compound Name2-[3-[3-(3-methylpyrazin-2-yl)phenyl]pyrazol-1-yl]-N-pyrazin-2-ylacetamide
PubChem CID30869523
Molecular FormulaC20H17N7O
Molecular Weight371.40 g/mol
Exact Mass371.15
IUPAC Name2-[3-[3-(3-methylpyrazin-2-yl)phenyl]pyrazol-1-yl]-N-pyrazin-2-ylacetamide
SMILESCc1nccnc1-c1cccc(-c2ccn(CC(=O)Nc3cnccn3)n2)c1
InChIInChI=1S/C20H17N7O/c1-14-20(24-9-8-22-14)16-4-2-3-15(11-16)17-5-10-27(26-17)13-19(28)25-18-12-21-6-7-23-18/h2-12H,13H2,1H3,(H,23,25,28)
InChIKeyOQHBTXHLPQNHNE-UHFFFAOYSA-N
XLogP2.74
TPSA98.48 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.40
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-(2-ethyltriazol-4-yl)-2-[3-(3-methylpyrazin-2-yl)pyrazol-1-yl]acetamide
CID 46989829
2,5-dimethyl-3-[3-[1-(2-methylprop-2-enyl)pyrazol-3-yl]phenyl]pyrazine
CID 29257494
N-(1-phenylethyl)-2-[3-(3-pyrimidin-5-ylphenyl)pyrazol-1-yl]acetamide
CID 45177485
2-[4-(2-methyl-4-pyridinyl)imidazo[4,5-c]pyridin-1-yl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide
CID 121280704
2-[3-[1-[2-(1-methylpyrrolidin-2-yl)ethyl]pyrazol-3-yl]phenyl]pyrazine
CID 45224958
N-[2-(1-phenylethyl)pyrazol-3-yl]-2-(3-pyridin-3-ylpyrazol-1-yl)acetamide;2,2,2-trifluoroacetic acid
CID 154886751
2,5-dimethyl-3-[3-[1-[2-(1-methylpyrrolidin-2-yl)ethyl]pyrazol-3-yl]phenyl]pyrazine
CID 45203148
2-methoxy-3-[3-[1-[(3-methyl-2-pyridinyl)methyl]pyrazol-3-yl]phenyl]pyrazine
CID 29151786
2-(3-chlorophenyl)-N-pyrazin-2-ylacetamide
CID 127120451
2-(3-aminopyrazol-1-yl)-N-(5-methyl-1H-pyrazol-3-yl)acetamide
CID 63819555
3-[[3-(3-phenylphenyl)pyrazol-1-yl]methyl]pyridine-4-carboxamide
CID 169043311
N-pyrazin-2-yl-2-[[(2S)-2-pyridin-3-yloxypropyl]amino]acetamide
CID 95131886

Frequently Asked Questions

What is the IUPAC name of 2-[3-[3-(3-methylpyrazin-2-yl)phenyl]pyrazol-1-yl]-N-pyrazin-2-ylacetamide?
The IUPAC name of 2-[3-[3-(3-methylpyrazin-2-yl)phenyl]pyrazol-1-yl]-N-pyrazin-2-ylacetamide (CID 30869523) is 2-[3-[3-(3-methylpyrazin-2-yl)phenyl]pyrazol-1-yl]-N-pyrazin-2-ylacetamide.
What is the SMILES notation for 2-[3-[3-(3-methylpyrazin-2-yl)phenyl]pyrazol-1-yl]-N-pyrazin-2-ylacetamide?
The canonical SMILES for 2-[3-[3-(3-methylpyrazin-2-yl)phenyl]pyrazol-1-yl]-N-pyrazin-2-ylacetamide is Cc1nccnc1-c1cccc(-c2ccn(CC(=O)Nc3cnccn3)n2)c1.
What is the InChIKey of 2-[3-[3-(3-methylpyrazin-2-yl)phenyl]pyrazol-1-yl]-N-pyrazin-2-ylacetamide?
The InChIKey is OQHBTXHLPQNHNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N7O/c1-14-20(24-9-8-22-14)16-4-2-3-15(11-16)17-5-10-27(26-17)13-19(28)25-18-12-21-6-7-23-18/h2-12H,13H2,1H3,(H,23,25,28).
What are the key properties of 2-[3-[3-(3-methylpyrazin-2-yl)phenyl]pyrazol-1-yl]-N-pyrazin-2-ylacetamide?
2-[3-[3-(3-methylpyrazin-2-yl)phenyl]pyrazol-1-yl]-N-pyrazin-2-ylacetamide has a molecular weight of 371.40 g/mol, XLogP of 2.74, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[3-(3-methylpyrazin-2-yl)phenyl]pyrazol-1-yl]-N-pyrazin-2-ylacetamide is sourced from PubChem (CID 30869523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).