[2-(furan-2-yl)quinolin-4-yl]-(1-methylimidazol-2-yl)methanone

C18H13N3O2 — CID 4173674

IUPAC[2-(furan-2-yl)quinolin-4-yl]-(1-methylimidazol-2-yl)methanone
SMILESCn1ccnc1C(=O)c1cc(-c2ccco2)nc2ccccc12
InChIInChI=1S/C18H13N3O2/c1-21-9-8-19-18(21)17(22)13-11-15(16-7-4-10-23-16)20-14-6-3-2-5-12(13)14/h2-11H,1H3
InChIKeyGNMQBEPIKJLKTC-UHFFFAOYSA-N
MW303.32 g/mol
LogP3.46
Rot. Bonds3

About [2-(furan-2-yl)quinolin-4-yl]-(1-methylimidazol-2-yl)methanone

[2-(furan-2-yl)quinolin-4-yl]-(1-methylimidazol-2-yl)methanone (PubChem CID 4173674) has the molecular formula C18H13N3O2 and a molecular weight of 303.32 g/mol. Its IUPAC name is [2-(furan-2-yl)quinolin-4-yl]-(1-methylimidazol-2-yl)methanone.

Molecular Properties

Compound Name[2-(furan-2-yl)quinolin-4-yl]-(1-methylimidazol-2-yl)methanone
PubChem CID4173674
Molecular FormulaC18H13N3O2
Molecular Weight303.32 g/mol
Exact Mass303.10
IUPAC Name[2-(furan-2-yl)quinolin-4-yl]-(1-methylimidazol-2-yl)methanone
SMILESCn1ccnc1C(=O)c1cc(-c2ccco2)nc2ccccc12
InChIInChI=1S/C18H13N3O2/c1-21-9-8-19-18(21)17(22)13-11-15(16-7-4-10-23-16)20-14-6-3-2-5-12(13)14/h2-11H,1H3
InChIKeyGNMQBEPIKJLKTC-UHFFFAOYSA-N
XLogP3.46
TPSA60.92 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.32
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [2-(furan-2-yl)quinolin-4-yl]-(1-methylimidazol-2-yl)methanone?
The IUPAC name of [2-(furan-2-yl)quinolin-4-yl]-(1-methylimidazol-2-yl)methanone (CID 4173674) is [2-(furan-2-yl)quinolin-4-yl]-(1-methylimidazol-2-yl)methanone.
What is the SMILES notation for [2-(furan-2-yl)quinolin-4-yl]-(1-methylimidazol-2-yl)methanone?
The canonical SMILES for [2-(furan-2-yl)quinolin-4-yl]-(1-methylimidazol-2-yl)methanone is Cn1ccnc1C(=O)c1cc(-c2ccco2)nc2ccccc12.
What is the InChIKey of [2-(furan-2-yl)quinolin-4-yl]-(1-methylimidazol-2-yl)methanone?
The InChIKey is GNMQBEPIKJLKTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13N3O2/c1-21-9-8-19-18(21)17(22)13-11-15(16-7-4-10-23-16)20-14-6-3-2-5-12(13)14/h2-11H,1H3.
What are the key properties of [2-(furan-2-yl)quinolin-4-yl]-(1-methylimidazol-2-yl)methanone?
[2-(furan-2-yl)quinolin-4-yl]-(1-methylimidazol-2-yl)methanone has a molecular weight of 303.32 g/mol, XLogP of 3.46, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(furan-2-yl)quinolin-4-yl]-(1-methylimidazol-2-yl)methanone is sourced from PubChem (CID 4173674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).