3-(3-methoxypyrazin-2-yl)cyclopent-2-en-1-one

C10H10N2O2 — CID 104516383

IUPAC3-(3-methoxypyrazin-2-yl)cyclopent-2-en-1-one
SMILESCOc1nccnc1C1=CC(=O)CC1
InChIInChI=1S/C10H10N2O2/c1-14-10-9(11-4-5-12-10)7-2-3-8(13)6-7/h4-6H,2-3H2,1H3
InChIKeyBCQOAIDXUPDJHD-UHFFFAOYSA-N
MW190.20 g/mol
LogP1.23
Rot. Bonds2

About 3-(3-methoxypyrazin-2-yl)cyclopent-2-en-1-one

3-(3-methoxypyrazin-2-yl)cyclopent-2-en-1-one (PubChem CID 104516383) has the molecular formula C10H10N2O2 and a molecular weight of 190.20 g/mol. Its IUPAC name is 3-(3-methoxypyrazin-2-yl)cyclopent-2-en-1-one.

Molecular Properties

Compound Name3-(3-methoxypyrazin-2-yl)cyclopent-2-en-1-one
PubChem CID104516383
Molecular FormulaC10H10N2O2
Molecular Weight190.20 g/mol
Exact Mass190.07
IUPAC Name3-(3-methoxypyrazin-2-yl)cyclopent-2-en-1-one
SMILESCOc1nccnc1C1=CC(=O)CC1
InChIInChI=1S/C10H10N2O2/c1-14-10-9(11-4-5-12-10)7-2-3-8(13)6-7/h4-6H,2-3H2,1H3
InChIKeyBCQOAIDXUPDJHD-UHFFFAOYSA-N
XLogP1.23
TPSA52.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.20
LogP ≤ 51.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-chlorocyclopenten-1-yl)-3-methoxypyrazine
CID 104516505
3-(3-methoxypyrazin-2-yl)cyclopent-2-en-1-ol
CID 104516471
2-(3-methoxypyrazin-2-yl)cyclohex-2-en-1-one
CID 130518104
2-methoxy-3-pyridin-2-ylpyrazine
CID 91147636
2-(5-chloropyrimidin-4-yl)-3-methoxypyrazine
CID 105371526
3-(2,6-dimethoxyphenyl)cyclopent-2-en-1-one
CID 116811052
2-(3-methoxypyrazin-2-yl)benzaldehyde
CID 104516168
4-(3-methoxypyrazin-2-yl)benzoic acid
CID 67257988
4-(3-methoxypyrazin-2-yl)-2,3-dihydro-1H-indole
CID 116698410
2-(3-methoxypyrazin-2-yl)aniline
CID 104516148
3-(4-ethoxyphenyl)cyclopent-2-en-1-one
CID 39240486
2-(6-chloropyrimidin-4-yl)-3-methoxypyrazine
CID 104516547

Frequently Asked Questions

What is the IUPAC name of 3-(3-methoxypyrazin-2-yl)cyclopent-2-en-1-one?
The IUPAC name of 3-(3-methoxypyrazin-2-yl)cyclopent-2-en-1-one (CID 104516383) is 3-(3-methoxypyrazin-2-yl)cyclopent-2-en-1-one.
What is the SMILES notation for 3-(3-methoxypyrazin-2-yl)cyclopent-2-en-1-one?
The canonical SMILES for 3-(3-methoxypyrazin-2-yl)cyclopent-2-en-1-one is COc1nccnc1C1=CC(=O)CC1.
What is the InChIKey of 3-(3-methoxypyrazin-2-yl)cyclopent-2-en-1-one?
The InChIKey is BCQOAIDXUPDJHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O2/c1-14-10-9(11-4-5-12-10)7-2-3-8(13)6-7/h4-6H,2-3H2,1H3.
What are the key properties of 3-(3-methoxypyrazin-2-yl)cyclopent-2-en-1-one?
3-(3-methoxypyrazin-2-yl)cyclopent-2-en-1-one has a molecular weight of 190.20 g/mol, XLogP of 1.23, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methoxypyrazin-2-yl)cyclopent-2-en-1-one is sourced from PubChem (CID 104516383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).