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

C16H20N2O4 — CID 30132802

IUPAC1-ethyl-6-methoxy-N-(2-methoxyethyl)-4-oxoquinoline-3-carboxamide
SMILESCCn1cc(C(=O)NCCOC)c(=O)c2cc(OC)ccc21
InChIInChI=1S/C16H20N2O4/c1-4-18-10-13(16(20)17-7-8-21-2)15(19)12-9-11(22-3)5-6-14(12)18/h5-6,9-10H,4,7-8H2,1-3H3,(H,17,20)
InChIKeyWSCPDGOUUMOEJF-UHFFFAOYSA-N
MW304.35 g/mol
LogP1.41
Rot. Bonds6

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

1-ethyl-6-methoxy-N-(2-methoxyethyl)-4-oxoquinoline-3-carboxamide (PubChem CID 30132802) has the molecular formula C16H20N2O4 and a molecular weight of 304.35 g/mol. Its IUPAC name is 1-ethyl-6-methoxy-N-(2-methoxyethyl)-4-oxoquinoline-3-carboxamide.

Molecular Properties

Compound Name1-ethyl-6-methoxy-N-(2-methoxyethyl)-4-oxoquinoline-3-carboxamide
PubChem CID30132802
Molecular FormulaC16H20N2O4
Molecular Weight304.35 g/mol
Exact Mass304.14
IUPAC Name1-ethyl-6-methoxy-N-(2-methoxyethyl)-4-oxoquinoline-3-carboxamide
SMILESCCn1cc(C(=O)NCCOC)c(=O)c2cc(OC)ccc21
InChIInChI=1S/C16H20N2O4/c1-4-18-10-13(16(20)17-7-8-21-2)15(19)12-9-11(22-3)5-6-14(12)18/h5-6,9-10H,4,7-8H2,1-3H3,(H,17,20)
InChIKeyWSCPDGOUUMOEJF-UHFFFAOYSA-N
XLogP1.41
TPSA69.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-ethyl-6-methoxy-N-[(4-methylphenyl)methyl]-4-oxoquinoline-3-carboxamide
CID 30132807
1-ethyl-N-(3-methoxypropyl)-4-oxo-6-(trifluoromethyl)quinoline-3-carboxamide
CID 30133526
1-ethyl-6-methoxy-4-oxo-N-(4-propan-2-ylphenyl)quinoline-3-carboxamide
CID 30132855
1-ethyl-6-methoxy-4-oxo-N-[(1S)-1-phenylethyl]quinoline-3-carboxamide
CID 30132817
N-(5-chloro-2-methoxyphenyl)-1-ethyl-6-methoxy-4-oxoquinoline-3-carboxamide
CID 30132938
N-(2,5-difluorophenyl)-1-ethyl-6-methoxy-4-oxoquinoline-3-carboxamide
CID 30133112
N-(3-acetylphenyl)-1-ethyl-6-methoxy-4-oxoquinoline-3-carboxamide
CID 42582572
1-ethyl-6-methoxy-N-(6-methyl-2-pyridinyl)-4-oxoquinoline-3-carboxamide
CID 27243880
1-ethyl-6-methoxy-N-(4-methyl-2-pyridinyl)-4-oxoquinoline-3-carboxamide
CID 27260830
N-[1-(4-bromophenyl)ethyl]-1-ethyl-6-methoxy-4-oxoquinoline-3-carboxamide
CID 43888757
1-ethyl-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-6-methoxy-4-oxoquinoline-3-carboxamide
CID 42570073
1-ethyl-6-methoxy-N-(4-methyl-1,3-thiazol-2-yl)-4-oxoquinoline-3-carboxamide
CID 27245376

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-6-methoxy-N-(2-methoxyethyl)-4-oxoquinoline-3-carboxamide?
The IUPAC name of 1-ethyl-6-methoxy-N-(2-methoxyethyl)-4-oxoquinoline-3-carboxamide (CID 30132802) is 1-ethyl-6-methoxy-N-(2-methoxyethyl)-4-oxoquinoline-3-carboxamide.
What is the SMILES notation for 1-ethyl-6-methoxy-N-(2-methoxyethyl)-4-oxoquinoline-3-carboxamide?
The canonical SMILES for 1-ethyl-6-methoxy-N-(2-methoxyethyl)-4-oxoquinoline-3-carboxamide is CCn1cc(C(=O)NCCOC)c(=O)c2cc(OC)ccc21.
What is the InChIKey of 1-ethyl-6-methoxy-N-(2-methoxyethyl)-4-oxoquinoline-3-carboxamide?
The InChIKey is WSCPDGOUUMOEJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O4/c1-4-18-10-13(16(20)17-7-8-21-2)15(19)12-9-11(22-3)5-6-14(12)18/h5-6,9-10H,4,7-8H2,1-3H3,(H,17,20).
What are the key properties of 1-ethyl-6-methoxy-N-(2-methoxyethyl)-4-oxoquinoline-3-carboxamide?
1-ethyl-6-methoxy-N-(2-methoxyethyl)-4-oxoquinoline-3-carboxamide has a molecular weight of 304.35 g/mol, XLogP of 1.41, 6 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-(2-methoxyethyl)-4-oxoquinoline-3-carboxamide is sourced from PubChem (CID 30132802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).