N-(3-acetamido-4-methoxyphenyl)-2-(furan-2-yl)quinoline-4-carboxamide

C23H19N3O4 — CID 35346205

IUPACN-(3-acetamido-4-methoxyphenyl)-2-(furan-2-yl)quinoline-4-carboxamide
SMILESCOc1ccc(NC(=O)c2cc(-c3ccco3)nc3ccccc23)cc1NC(C)=O
InChIInChI=1S/C23H19N3O4/c1-14(27)24-19-12-15(9-10-21(19)29-2)25-23(28)17-13-20(22-8-5-11-30-22)26-18-7-4-3-6-16(17)18/h3-13H,1-2H3,(H,24,27)(H,25,28)
InChIKeyVPWCPLMDKQBEKK-UHFFFAOYSA-N
MW401.42 g/mol
LogP4.71
Rot. Bonds5

About N-(3-acetamido-4-methoxyphenyl)-2-(furan-2-yl)quinoline-4-carboxamide

N-(3-acetamido-4-methoxyphenyl)-2-(furan-2-yl)quinoline-4-carboxamide (PubChem CID 35346205) has the molecular formula C23H19N3O4 and a molecular weight of 401.42 g/mol. Its IUPAC name is N-(3-acetamido-4-methoxyphenyl)-2-(furan-2-yl)quinoline-4-carboxamide.

Molecular Properties

Compound NameN-(3-acetamido-4-methoxyphenyl)-2-(furan-2-yl)quinoline-4-carboxamide
PubChem CID35346205
Molecular FormulaC23H19N3O4
Molecular Weight401.42 g/mol
Exact Mass401.14
IUPAC NameN-(3-acetamido-4-methoxyphenyl)-2-(furan-2-yl)quinoline-4-carboxamide
SMILESCOc1ccc(NC(=O)c2cc(-c3ccco3)nc3ccccc23)cc1NC(C)=O
InChIInChI=1S/C23H19N3O4/c1-14(27)24-19-12-15(9-10-21(19)29-2)25-23(28)17-13-20(22-8-5-11-30-22)26-18-7-4-3-6-16(17)18/h3-13H,1-2H3,(H,24,27)(H,25,28)
InChIKeyVPWCPLMDKQBEKK-UHFFFAOYSA-N
XLogP4.71
TPSA93.46 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.42
LogP ≤ 54.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-chloro-4-methoxyphenyl)-2-(furan-2-yl)quinoline-4-carboxamide
CID 2361920
N-(3,5-dimethoxyphenyl)-2-(furan-2-yl)quinoline-4-carboxamide
CID 9096906
2-(furan-2-yl)-N-[4-[4-[[2-(furan-2-yl)quinoline-4-carbonyl]amino]phenoxy]phenyl]quinoline-4-carboxamide
CID 3663828
2-(furan-2-yl)-N-[4-(2-methylpropanoylamino)phenyl]quinoline-4-carboxamide
CID 134016603
2-(furan-2-yl)-N-[4-(propan-2-ylcarbamoyl)phenyl]quinoline-4-carboxamide
CID 55864663
N-(5-acetamido-2-methoxyphenyl)-2-(2,4-dimethylphenyl)quinoline-4-carboxamide
CID 26243054
N-(5-acetamido-2-methoxyphenyl)-6-(furan-2-yl)-3-methyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 17492785
N-(2-ethoxyphenyl)-2-(furan-2-yl)quinoline-4-carboxamide
CID 3391261
2-(furan-2-yl)-N-(2-phenoxyphenyl)quinoline-4-carboxamide
CID 4197636
2-(furan-2-yl)-N-[(Z)-(3-hydroxy-4-methoxyphenyl)methylideneamino]quinoline-4-carboxamide
CID 9214487
N-[4-[2-[2-[2-(furan-2-yl)quinoline-4-carbonyl]hydrazinyl]-2-oxoethyl]phenyl]acetamide
CID 134029227
N-(2,4-dimethylphenyl)-2-(furan-2-yl)quinoline-4-carboxamide
CID 694750

Frequently Asked Questions

What is the IUPAC name of N-(3-acetamido-4-methoxyphenyl)-2-(furan-2-yl)quinoline-4-carboxamide?
The IUPAC name of N-(3-acetamido-4-methoxyphenyl)-2-(furan-2-yl)quinoline-4-carboxamide (CID 35346205) is N-(3-acetamido-4-methoxyphenyl)-2-(furan-2-yl)quinoline-4-carboxamide.
What is the SMILES notation for N-(3-acetamido-4-methoxyphenyl)-2-(furan-2-yl)quinoline-4-carboxamide?
The canonical SMILES for N-(3-acetamido-4-methoxyphenyl)-2-(furan-2-yl)quinoline-4-carboxamide is COc1ccc(NC(=O)c2cc(-c3ccco3)nc3ccccc23)cc1NC(C)=O.
What is the InChIKey of N-(3-acetamido-4-methoxyphenyl)-2-(furan-2-yl)quinoline-4-carboxamide?
The InChIKey is VPWCPLMDKQBEKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N3O4/c1-14(27)24-19-12-15(9-10-21(19)29-2)25-23(28)17-13-20(22-8-5-11-30-22)26-18-7-4-3-6-16(17)18/h3-13H,1-2H3,(H,24,27)(H,25,28).
What are the key properties of N-(3-acetamido-4-methoxyphenyl)-2-(furan-2-yl)quinoline-4-carboxamide?
N-(3-acetamido-4-methoxyphenyl)-2-(furan-2-yl)quinoline-4-carboxamide has a molecular weight of 401.42 g/mol, XLogP of 4.71, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamido-4-methoxyphenyl)-2-(furan-2-yl)quinoline-4-carboxamide is sourced from PubChem (CID 35346205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).