1-ethyl-6-methoxy-N-(6-methyl-2-pyridinyl)-4-oxoquinoline-3-carboxamide

C19H19N3O3 — CID 27243880

IUPAC1-ethyl-6-methoxy-N-(6-methyl-2-pyridinyl)-4-oxoquinoline-3-carboxamide
SMILESCCn1cc(C(=O)Nc2cccc(C)n2)c(=O)c2cc(OC)ccc21
InChIInChI=1S/C19H19N3O3/c1-4-22-11-15(19(24)21-17-7-5-6-12(2)20-17)18(23)14-10-13(25-3)8-9-16(14)22/h5-11H,4H2,1-3H3,(H,20,21,24)
InChIKeyWQVMWRAKCXCGFI-UHFFFAOYSA-N
MW337.38 g/mol
LogP2.99
Rot. Bonds4

About 1-ethyl-6-methoxy-N-(6-methyl-2-pyridinyl)-4-oxoquinoline-3-carboxamide

1-ethyl-6-methoxy-N-(6-methyl-2-pyridinyl)-4-oxoquinoline-3-carboxamide (PubChem CID 27243880) has the molecular formula C19H19N3O3 and a molecular weight of 337.38 g/mol. Its IUPAC name is 1-ethyl-6-methoxy-N-(6-methyl-2-pyridinyl)-4-oxoquinoline-3-carboxamide.

Molecular Properties

Compound Name1-ethyl-6-methoxy-N-(6-methyl-2-pyridinyl)-4-oxoquinoline-3-carboxamide
PubChem CID27243880
Molecular FormulaC19H19N3O3
Molecular Weight337.38 g/mol
Exact Mass337.14
IUPAC Name1-ethyl-6-methoxy-N-(6-methyl-2-pyridinyl)-4-oxoquinoline-3-carboxamide
SMILESCCn1cc(C(=O)Nc2cccc(C)n2)c(=O)c2cc(OC)ccc21
InChIInChI=1S/C19H19N3O3/c1-4-22-11-15(19(24)21-17-7-5-6-12(2)20-17)18(23)14-10-13(25-3)8-9-16(14)22/h5-11H,4H2,1-3H3,(H,20,21,24)
InChIKeyWQVMWRAKCXCGFI-UHFFFAOYSA-N
XLogP2.99
TPSA73.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-6-methoxy-N-(6-methyl-2-pyridinyl)-4-oxoquinoline-3-carboxamide?
The IUPAC name of 1-ethyl-6-methoxy-N-(6-methyl-2-pyridinyl)-4-oxoquinoline-3-carboxamide (CID 27243880) is 1-ethyl-6-methoxy-N-(6-methyl-2-pyridinyl)-4-oxoquinoline-3-carboxamide.
What is the SMILES notation for 1-ethyl-6-methoxy-N-(6-methyl-2-pyridinyl)-4-oxoquinoline-3-carboxamide?
The canonical SMILES for 1-ethyl-6-methoxy-N-(6-methyl-2-pyridinyl)-4-oxoquinoline-3-carboxamide is CCn1cc(C(=O)Nc2cccc(C)n2)c(=O)c2cc(OC)ccc21.
What is the InChIKey of 1-ethyl-6-methoxy-N-(6-methyl-2-pyridinyl)-4-oxoquinoline-3-carboxamide?
The InChIKey is WQVMWRAKCXCGFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O3/c1-4-22-11-15(19(24)21-17-7-5-6-12(2)20-17)18(23)14-10-13(25-3)8-9-16(14)22/h5-11H,4H2,1-3H3,(H,20,21,24).
What are the key properties of 1-ethyl-6-methoxy-N-(6-methyl-2-pyridinyl)-4-oxoquinoline-3-carboxamide?
1-ethyl-6-methoxy-N-(6-methyl-2-pyridinyl)-4-oxoquinoline-3-carboxamide has a molecular weight of 337.38 g/mol, XLogP of 2.99, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-6-methoxy-N-(6-methyl-2-pyridinyl)-4-oxoquinoline-3-carboxamide is sourced from PubChem (CID 27243880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).