(3-methoxypyrazin-2-yl)-(1-methylcyclopropyl)methanone

C10H12N2O2 — CID 104515026

IUPAC(3-methoxypyrazin-2-yl)-(1-methylcyclopropyl)methanone
SMILESCOc1nccnc1C(=O)C1(C)CC1
InChIInChI=1S/C10H12N2O2/c1-10(3-4-10)8(13)7-9(14-2)12-6-5-11-7/h5-6H,3-4H2,1-2H3
InChIKeyKXYOZHZXDLEDCZ-UHFFFAOYSA-N
MW192.22 g/mol
LogP1.47
Rot. Bonds3

About (3-methoxypyrazin-2-yl)-(1-methylcyclopropyl)methanone

(3-methoxypyrazin-2-yl)-(1-methylcyclopropyl)methanone (PubChem CID 104515026) has the molecular formula C10H12N2O2 and a molecular weight of 192.22 g/mol. Its IUPAC name is (3-methoxypyrazin-2-yl)-(1-methylcyclopropyl)methanone.

Molecular Properties

Compound Name(3-methoxypyrazin-2-yl)-(1-methylcyclopropyl)methanone
PubChem CID104515026
Molecular FormulaC10H12N2O2
Molecular Weight192.22 g/mol
Exact Mass192.09
IUPAC Name(3-methoxypyrazin-2-yl)-(1-methylcyclopropyl)methanone
SMILESCOc1nccnc1C(=O)C1(C)CC1
InChIInChI=1S/C10H12N2O2/c1-10(3-4-10)8(13)7-9(14-2)12-6-5-11-7/h5-6H,3-4H2,1-2H3
InChIKeyKXYOZHZXDLEDCZ-UHFFFAOYSA-N
XLogP1.47
TPSA52.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.22
LogP ≤ 51.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (3-methoxypyrazin-2-yl)-(1-methylcyclopropyl)methanone?
The IUPAC name of (3-methoxypyrazin-2-yl)-(1-methylcyclopropyl)methanone (CID 104515026) is (3-methoxypyrazin-2-yl)-(1-methylcyclopropyl)methanone.
What is the SMILES notation for (3-methoxypyrazin-2-yl)-(1-methylcyclopropyl)methanone?
The canonical SMILES for (3-methoxypyrazin-2-yl)-(1-methylcyclopropyl)methanone is COc1nccnc1C(=O)C1(C)CC1.
What is the InChIKey of (3-methoxypyrazin-2-yl)-(1-methylcyclopropyl)methanone?
The InChIKey is KXYOZHZXDLEDCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O2/c1-10(3-4-10)8(13)7-9(14-2)12-6-5-11-7/h5-6H,3-4H2,1-2H3.
What are the key properties of (3-methoxypyrazin-2-yl)-(1-methylcyclopropyl)methanone?
(3-methoxypyrazin-2-yl)-(1-methylcyclopropyl)methanone has a molecular weight of 192.22 g/mol, XLogP of 1.47, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methoxypyrazin-2-yl)-(1-methylcyclopropyl)methanone is sourced from PubChem (CID 104515026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).