1-ethyl-6-methoxy-4-oxo-N-(4-propan-2-ylphenyl)quinoline-3-carboxamide

C22H24N2O3 — CID 30132855

IUPAC1-ethyl-6-methoxy-4-oxo-N-(4-propan-2-ylphenyl)quinoline-3-carboxamide
SMILESCCn1cc(C(=O)Nc2ccc(C(C)C)cc2)c(=O)c2cc(OC)ccc21
InChIInChI=1S/C22H24N2O3/c1-5-24-13-19(21(25)18-12-17(27-4)10-11-20(18)24)22(26)23-16-8-6-15(7-9-16)14(2)3/h6-14H,5H2,1-4H3,(H,23,26)
InChIKeyJOWCNXJCQBYNIL-UHFFFAOYSA-N
MW364.45 g/mol
LogP4.41
Rot. Bonds5

About 1-ethyl-6-methoxy-4-oxo-N-(4-propan-2-ylphenyl)quinoline-3-carboxamide

1-ethyl-6-methoxy-4-oxo-N-(4-propan-2-ylphenyl)quinoline-3-carboxamide (PubChem CID 30132855) has the molecular formula C22H24N2O3 and a molecular weight of 364.45 g/mol. Its IUPAC name is 1-ethyl-6-methoxy-4-oxo-N-(4-propan-2-ylphenyl)quinoline-3-carboxamide.

Molecular Properties

Compound Name1-ethyl-6-methoxy-4-oxo-N-(4-propan-2-ylphenyl)quinoline-3-carboxamide
PubChem CID30132855
Molecular FormulaC22H24N2O3
Molecular Weight364.45 g/mol
Exact Mass364.18
IUPAC Name1-ethyl-6-methoxy-4-oxo-N-(4-propan-2-ylphenyl)quinoline-3-carboxamide
SMILESCCn1cc(C(=O)Nc2ccc(C(C)C)cc2)c(=O)c2cc(OC)ccc21
InChIInChI=1S/C22H24N2O3/c1-5-24-13-19(21(25)18-12-17(27-4)10-11-20(18)24)22(26)23-16-8-6-15(7-9-16)14(2)3/h6-14H,5H2,1-4H3,(H,23,26)
InChIKeyJOWCNXJCQBYNIL-UHFFFAOYSA-N
XLogP4.41
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-acetylphenyl)-1-ethyl-6-methoxy-4-oxoquinoline-3-carboxamide
CID 42582572
N-[1-(4-bromophenyl)ethyl]-1-ethyl-6-methoxy-4-oxoquinoline-3-carboxamide
CID 43888757
1-ethyl-6-methoxy-4-oxo-N-[(1S)-1-phenylethyl]quinoline-3-carboxamide
CID 30132817
6-ethoxy-1-methyl-4-oxo-N-(4-propan-2-ylphenyl)quinoline-3-carboxamide
CID 30133888
N-(5-chloro-2-methoxyphenyl)-1-ethyl-6-methoxy-4-oxoquinoline-3-carboxamide
CID 30132938
1-ethyl-6-methoxy-N-(2-methoxyethyl)-4-oxoquinoline-3-carboxamide
CID 30132802
N-(2,5-difluorophenyl)-1-ethyl-6-methoxy-4-oxoquinoline-3-carboxamide
CID 30133112
1-ethyl-6-methoxy-N-(4-methyl-2-pyridinyl)-4-oxoquinoline-3-carboxamide
CID 27260830
1-ethyl-6-methoxy-N-(6-methyl-2-pyridinyl)-4-oxoquinoline-3-carboxamide
CID 27243880
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
N-(2,5-dimethoxyphenyl)-1-ethyl-6-fluoro-4-oxoquinoline-3-carboxamide
CID 39850934

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-6-methoxy-4-oxo-N-(4-propan-2-ylphenyl)quinoline-3-carboxamide?
The IUPAC name of 1-ethyl-6-methoxy-4-oxo-N-(4-propan-2-ylphenyl)quinoline-3-carboxamide (CID 30132855) is 1-ethyl-6-methoxy-4-oxo-N-(4-propan-2-ylphenyl)quinoline-3-carboxamide.
What is the SMILES notation for 1-ethyl-6-methoxy-4-oxo-N-(4-propan-2-ylphenyl)quinoline-3-carboxamide?
The canonical SMILES for 1-ethyl-6-methoxy-4-oxo-N-(4-propan-2-ylphenyl)quinoline-3-carboxamide is CCn1cc(C(=O)Nc2ccc(C(C)C)cc2)c(=O)c2cc(OC)ccc21.
What is the InChIKey of 1-ethyl-6-methoxy-4-oxo-N-(4-propan-2-ylphenyl)quinoline-3-carboxamide?
The InChIKey is JOWCNXJCQBYNIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O3/c1-5-24-13-19(21(25)18-12-17(27-4)10-11-20(18)24)22(26)23-16-8-6-15(7-9-16)14(2)3/h6-14H,5H2,1-4H3,(H,23,26).
What are the key properties of 1-ethyl-6-methoxy-4-oxo-N-(4-propan-2-ylphenyl)quinoline-3-carboxamide?
1-ethyl-6-methoxy-4-oxo-N-(4-propan-2-ylphenyl)quinoline-3-carboxamide has a molecular weight of 364.45 g/mol, XLogP of 4.41, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-6-methoxy-4-oxo-N-(4-propan-2-ylphenyl)quinoline-3-carboxamide is sourced from PubChem (CID 30132855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).