(3-methoxypyrazin-2-yl)-quinolin-4-ylmethanone

C15H11N3O2 — CID 105126876

IUPAC(3-methoxypyrazin-2-yl)-quinolin-4-ylmethanone
SMILESCOc1nccnc1C(=O)c1ccnc2ccccc12
InChIInChI=1S/C15H11N3O2/c1-20-15-13(17-8-9-18-15)14(19)11-6-7-16-12-5-3-2-4-10(11)12/h2-9H,1H3
InChIKeyKXBALRPSJHRBFN-UHFFFAOYSA-N
MW265.27 g/mol
LogP2.26
Rot. Bonds3

About (3-methoxypyrazin-2-yl)-quinolin-4-ylmethanone

(3-methoxypyrazin-2-yl)-quinolin-4-ylmethanone (PubChem CID 105126876) has the molecular formula C15H11N3O2 and a molecular weight of 265.27 g/mol. Its IUPAC name is (3-methoxypyrazin-2-yl)-quinolin-4-ylmethanone.

Molecular Properties

Compound Name(3-methoxypyrazin-2-yl)-quinolin-4-ylmethanone
PubChem CID105126876
Molecular FormulaC15H11N3O2
Molecular Weight265.27 g/mol
Exact Mass265.09
IUPAC Name(3-methoxypyrazin-2-yl)-quinolin-4-ylmethanone
SMILESCOc1nccnc1C(=O)c1ccnc2ccccc12
InChIInChI=1S/C15H11N3O2/c1-20-15-13(17-8-9-18-15)14(19)11-6-7-16-12-5-3-2-4-10(11)12/h2-9H,1H3
InChIKeyKXBALRPSJHRBFN-UHFFFAOYSA-N
XLogP2.26
TPSA64.97 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.27
LogP ≤ 52.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

(2-iodophenyl)-(3-methoxypyrazin-2-yl)methanone
CID 115797174
(3-methoxyphenyl)-quinolin-4-ylmethanone
CID 86811128
(3-methoxypyrazin-2-yl)-(1-methylindazol-3-yl)methanone
CID 103125238
(5-methoxy-3-pyridinyl)-quinolin-4-ylmethanone
CID 105123960
(3-methyl-2-pyridinyl)-quinolin-5-ylmethanone
CID 81220476
2,2-dimethyl-1-quinolin-4-ylpropan-1-one
CID 12913278
quinoline-4-carbonyl cyanide
CID 119091066
(4-iodophenyl)-quinolin-4-ylmethanone
CID 86811146
(2,4-dimethylphenyl)-quinolin-4-ylmethanone
CID 86811186
2-hydroxy-1-quinolin-4-ylpropan-1-one
CID 175106314
(4-bromo-2-methylphenyl)-(3-methoxypyrazin-2-yl)methanone
CID 115797276
(2-bromo-5-methylphenyl)-(3-methoxypyrazin-2-yl)methanone
CID 115797057

Frequently Asked Questions

What is the IUPAC name of (3-methoxypyrazin-2-yl)-quinolin-4-ylmethanone?
The IUPAC name of (3-methoxypyrazin-2-yl)-quinolin-4-ylmethanone (CID 105126876) is (3-methoxypyrazin-2-yl)-quinolin-4-ylmethanone.
What is the SMILES notation for (3-methoxypyrazin-2-yl)-quinolin-4-ylmethanone?
The canonical SMILES for (3-methoxypyrazin-2-yl)-quinolin-4-ylmethanone is COc1nccnc1C(=O)c1ccnc2ccccc12.
What is the InChIKey of (3-methoxypyrazin-2-yl)-quinolin-4-ylmethanone?
The InChIKey is KXBALRPSJHRBFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N3O2/c1-20-15-13(17-8-9-18-15)14(19)11-6-7-16-12-5-3-2-4-10(11)12/h2-9H,1H3.
What are the key properties of (3-methoxypyrazin-2-yl)-quinolin-4-ylmethanone?
(3-methoxypyrazin-2-yl)-quinolin-4-ylmethanone has a molecular weight of 265.27 g/mol, XLogP of 2.26, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methoxypyrazin-2-yl)-quinolin-4-ylmethanone is sourced from PubChem (CID 105126876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).