2-methoxy-1-[2-[5-(5-methyl-1H-pyrazol-3-yl)pyrazin-2-yl]pyrrolidin-1-yl]ethanone

C15H19N5O2 — CID 110101473

IUPAC2-methoxy-1-[2-[5-(5-methyl-1H-pyrazol-3-yl)pyrazin-2-yl]pyrrolidin-1-yl]ethanone
SMILESCOCC(=O)N1CCCC1c1cnc(-c2cc(C)[nH]n2)cn1
InChIInChI=1S/C15H19N5O2/c1-10-6-11(19-18-10)12-7-17-13(8-16-12)14-4-3-5-20(14)15(21)9-22-2/h6-8,14H,3-5,9H2,1-2H3,(H,18,19)
InChIKeyMXADSAIALGQKSI-UHFFFAOYSA-N
MW301.35 g/mol
LogP1.49
Rot. Bonds4

About 2-methoxy-1-[2-[5-(5-methyl-1H-pyrazol-3-yl)pyrazin-2-yl]pyrrolidin-1-yl]ethanone

2-methoxy-1-[2-[5-(5-methyl-1H-pyrazol-3-yl)pyrazin-2-yl]pyrrolidin-1-yl]ethanone (PubChem CID 110101473) has the molecular formula C15H19N5O2 and a molecular weight of 301.35 g/mol. Its IUPAC name is 2-methoxy-1-[2-[5-(5-methyl-1H-pyrazol-3-yl)pyrazin-2-yl]pyrrolidin-1-yl]ethanone.

Molecular Properties

Compound Name2-methoxy-1-[2-[5-(5-methyl-1H-pyrazol-3-yl)pyrazin-2-yl]pyrrolidin-1-yl]ethanone
PubChem CID110101473
Molecular FormulaC15H19N5O2
Molecular Weight301.35 g/mol
Exact Mass301.15
IUPAC Name2-methoxy-1-[2-[5-(5-methyl-1H-pyrazol-3-yl)pyrazin-2-yl]pyrrolidin-1-yl]ethanone
SMILESCOCC(=O)N1CCCC1c1cnc(-c2cc(C)[nH]n2)cn1
InChIInChI=1S/C15H19N5O2/c1-10-6-11(19-18-10)12-7-17-13(8-16-12)14-4-3-5-20(14)15(21)9-22-2/h6-8,14H,3-5,9H2,1-2H3,(H,18,19)
InChIKeyMXADSAIALGQKSI-UHFFFAOYSA-N
XLogP1.49
TPSA84.00 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-methoxy-1-[(3S)-3-[5-(5-methyl-1H-pyrazol-3-yl)pyrazin-2-yl]piperidin-1-yl]ethanone
CID 124993641
1-[3-[5-(5-methyl-1H-pyrazol-3-yl)pyrazin-2-yl]piperidin-1-yl]ethanone
CID 110101486
1-[2-[2-(5-methyl-1H-pyrazol-3-yl)-4-pyridinyl]pyrrolidin-1-yl]ethanone
CID 110102001
1-[(2S)-2-(6-chloropyrazin-2-yl)pyrrolidin-1-yl]-2-methoxyethanone
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1-[(2R)-2-(6-chloropyrazin-2-yl)pyrrolidin-1-yl]-2-methoxyethanone
CID 125021297
1-[(2S)-2-[5-(1H-pyrazol-5-yl)pyrazin-2-yl]pyrrolidin-1-yl]ethanone
CID 124994513
2-methoxy-1-[(2R)-2-[2-methyl-6-(pyrimidin-2-ylamino)pyrimidin-4-yl]pyrrolidin-1-yl]ethanone
CID 95820518
1-[2-[6-[(4,6-dimethylpyrimidin-2-yl)amino]pyrazin-2-yl]pyrrolidin-1-yl]-2-methoxyethanone
CID 110265611
3-[6-[(2S)-1-(2-methoxyacetyl)pyrrolidin-2-yl]-2-methylpyrimidin-4-yl]propanamide
CID 95826823
1-[2-[3-(5-methyl-1H-pyrazol-3-yl)pyrazin-2-yl]pyrrolidin-1-yl]ethanone
CID 110101703
2-methoxy-1-[(2S)-2-[6-[(3-methyl-2-pyridinyl)amino]-2-pyridinyl]pyrrolidin-1-yl]ethanone
CID 95835160
1-[2-[4-[(4,6-dimethylpyrimidin-2-yl)amino]-6-methylpyrimidin-2-yl]pyrrolidin-1-yl]-2-methoxyethanone
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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-1-[2-[5-(5-methyl-1H-pyrazol-3-yl)pyrazin-2-yl]pyrrolidin-1-yl]ethanone?
The IUPAC name of 2-methoxy-1-[2-[5-(5-methyl-1H-pyrazol-3-yl)pyrazin-2-yl]pyrrolidin-1-yl]ethanone (CID 110101473) is 2-methoxy-1-[2-[5-(5-methyl-1H-pyrazol-3-yl)pyrazin-2-yl]pyrrolidin-1-yl]ethanone.
What is the SMILES notation for 2-methoxy-1-[2-[5-(5-methyl-1H-pyrazol-3-yl)pyrazin-2-yl]pyrrolidin-1-yl]ethanone?
The canonical SMILES for 2-methoxy-1-[2-[5-(5-methyl-1H-pyrazol-3-yl)pyrazin-2-yl]pyrrolidin-1-yl]ethanone is COCC(=O)N1CCCC1c1cnc(-c2cc(C)[nH]n2)cn1.
What is the InChIKey of 2-methoxy-1-[2-[5-(5-methyl-1H-pyrazol-3-yl)pyrazin-2-yl]pyrrolidin-1-yl]ethanone?
The InChIKey is MXADSAIALGQKSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O2/c1-10-6-11(19-18-10)12-7-17-13(8-16-12)14-4-3-5-20(14)15(21)9-22-2/h6-8,14H,3-5,9H2,1-2H3,(H,18,19).
What are the key properties of 2-methoxy-1-[2-[5-(5-methyl-1H-pyrazol-3-yl)pyrazin-2-yl]pyrrolidin-1-yl]ethanone?
2-methoxy-1-[2-[5-(5-methyl-1H-pyrazol-3-yl)pyrazin-2-yl]pyrrolidin-1-yl]ethanone has a molecular weight of 301.35 g/mol, XLogP of 1.49, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-1-[2-[5-(5-methyl-1H-pyrazol-3-yl)pyrazin-2-yl]pyrrolidin-1-yl]ethanone is sourced from PubChem (CID 110101473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).