N-(3-acetamidophenyl)quinoline-8-carboxamide

C18H15N3O2 — CID 9206616

IUPACN-(3-acetamidophenyl)quinoline-8-carboxamide
SMILESCC(=O)Nc1cccc(NC(=O)c2cccc3cccnc23)c1
InChIInChI=1S/C18H15N3O2/c1-12(22)20-14-7-3-8-15(11-14)21-18(23)16-9-2-5-13-6-4-10-19-17(13)16/h2-11H,1H3,(H,20,22)(H,21,23)
InChIKeyMLPUAFIDPVDNHG-UHFFFAOYSA-N
MW305.34 g/mol
LogP3.45
Rot. Bonds3

About N-(3-acetamidophenyl)quinoline-8-carboxamide

N-(3-acetamidophenyl)quinoline-8-carboxamide (PubChem CID 9206616) has the molecular formula C18H15N3O2 and a molecular weight of 305.34 g/mol. Its IUPAC name is N-(3-acetamidophenyl)quinoline-8-carboxamide.

Molecular Properties

Compound NameN-(3-acetamidophenyl)quinoline-8-carboxamide
PubChem CID9206616
Molecular FormulaC18H15N3O2
Molecular Weight305.34 g/mol
Exact Mass305.12
IUPAC NameN-(3-acetamidophenyl)quinoline-8-carboxamide
SMILESCC(=O)Nc1cccc(NC(=O)c2cccc3cccnc23)c1
InChIInChI=1S/C18H15N3O2/c1-12(22)20-14-7-3-8-15(11-14)21-18(23)16-9-2-5-13-6-4-10-19-17(13)16/h2-11H,1H3,(H,20,22)(H,21,23)
InChIKeyMLPUAFIDPVDNHG-UHFFFAOYSA-N
XLogP3.45
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.34
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-methylphenyl)quinoline-8-carboxamide
CID 30267656
N-(3-acetamidophenyl)-2-methylpyridine-3-carboxamide
CID 110861306
N-(5-acetamido-2-methoxyphenyl)quinoline-8-carboxamide
CID 17443177
N-[3-(bromomethyl)phenyl]quinoline-8-carboxamide
CID 114307205
N-pyrimidin-2-ylquinoline-8-carboxamide
CID 175780986
N-(4-amino-3-chlorophenyl)quinoline-8-carboxamide
CID 82863638
N-(2-phenylpyrimidin-5-yl)quinoline-8-carboxamide
CID 134009435
N-(2,3-dimethylphenyl)quinoline-8-carboxamide
CID 30267815
1-N-(3-acetamidophenyl)-1-N'-quinolin-8-ylcyclopropane-1,1-dicarboxamide
CID 108983466
N-[4-(2-methylsulfanylethyl)phenyl]quinoline-8-carboxamide
CID 154747549
N-(3-acetamidophenyl)-2-chlorobenzamide
CID 792012
N-(2-bromophenyl)quinoline-8-carboxamide
CID 60651885

Frequently Asked Questions

What is the IUPAC name of N-(3-acetamidophenyl)quinoline-8-carboxamide?
The IUPAC name of N-(3-acetamidophenyl)quinoline-8-carboxamide (CID 9206616) is N-(3-acetamidophenyl)quinoline-8-carboxamide.
What is the SMILES notation for N-(3-acetamidophenyl)quinoline-8-carboxamide?
The canonical SMILES for N-(3-acetamidophenyl)quinoline-8-carboxamide is CC(=O)Nc1cccc(NC(=O)c2cccc3cccnc23)c1.
What is the InChIKey of N-(3-acetamidophenyl)quinoline-8-carboxamide?
The InChIKey is MLPUAFIDPVDNHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3O2/c1-12(22)20-14-7-3-8-15(11-14)21-18(23)16-9-2-5-13-6-4-10-19-17(13)16/h2-11H,1H3,(H,20,22)(H,21,23).
What are the key properties of N-(3-acetamidophenyl)quinoline-8-carboxamide?
N-(3-acetamidophenyl)quinoline-8-carboxamide has a molecular weight of 305.34 g/mol, XLogP of 3.45, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamidophenyl)quinoline-8-carboxamide is sourced from PubChem (CID 9206616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).