N-[4-(3-acetamidophenyl)-8-methoxyquinolin-7-yl]acetamide

C20H19N3O3 — CID 155168993

IUPACN-[4-(3-acetamidophenyl)-8-methoxyquinolin-7-yl]acetamide
SMILESCOc1c(NC(C)=O)ccc2c(-c3cccc(NC(C)=O)c3)ccnc12
InChIInChI=1S/C20H19N3O3/c1-12(24)22-15-6-4-5-14(11-15)16-9-10-21-19-17(16)7-8-18(20(19)26-3)23-13(2)25/h4-11H,1-3H3,(H,22,24)(H,23,25)
InChIKeyGCDSEGMAIKYCQR-UHFFFAOYSA-N
MW349.39 g/mol
LogP3.83
Rot. Bonds4

About N-[4-(3-acetamidophenyl)-8-methoxyquinolin-7-yl]acetamide

N-[4-(3-acetamidophenyl)-8-methoxyquinolin-7-yl]acetamide (PubChem CID 155168993) has the molecular formula C20H19N3O3 and a molecular weight of 349.39 g/mol. Its IUPAC name is N-[4-(3-acetamidophenyl)-8-methoxyquinolin-7-yl]acetamide.

Molecular Properties

Compound NameN-[4-(3-acetamidophenyl)-8-methoxyquinolin-7-yl]acetamide
PubChem CID155168993
Molecular FormulaC20H19N3O3
Molecular Weight349.39 g/mol
Exact Mass349.14
IUPAC NameN-[4-(3-acetamidophenyl)-8-methoxyquinolin-7-yl]acetamide
SMILESCOc1c(NC(C)=O)ccc2c(-c3cccc(NC(C)=O)c3)ccnc12
InChIInChI=1S/C20H19N3O3/c1-12(24)22-15-6-4-5-14(11-15)16-9-10-21-19-17(16)7-8-18(20(19)26-3)23-13(2)25/h4-11H,1-3H3,(H,22,24)(H,23,25)
InChIKeyGCDSEGMAIKYCQR-UHFFFAOYSA-N
XLogP3.83
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.39
LogP ≤ 53.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(8-methoxy-4-phenylquinolin-7-yl)acetamide
CID 155168884
N-(8-methoxy-4-thiophen-2-ylquinolin-7-yl)acetamide
CID 155168948
N-[4-(5-fluoro-2-hydroxyphenyl)-8-methoxyquinolin-7-yl]acetamide
CID 155514305
N-[3-(4-methyl-2-pyridinyl)phenyl]acetamide
CID 143373898
N-[3-[2-(3-sulfamoylphenyl)-1H-pyrrolo[2,3-b]pyridin-4-yl]phenyl]acetamide
CID 67182767
N-[3-[2-(hydroxymethyl)-4-pyridinyl]phenyl]acetamide
CID 39773386
2-(3-acetamidophenyl)-5-methoxybenzoic acid
CID 53227035
3-(3-acetamidophenyl)pyridine-4-carboxylic acid
CID 53223642
2-(3-acetamidophenyl)pyridine-3-carboxylic acid
CID 53223643
methyl 2-acetamido-4-(3-methylphenyl)pyridine-3-carboxylate
CID 67694601
methyl N-[3-[2-(methylamino)-4-pyridinyl]phenyl]carbamate
CID 123674082
N-[3-(3-cyanopyrazin-2-yl)phenyl]acetamide
CID 50983123

Frequently Asked Questions

What is the IUPAC name of N-[4-(3-acetamidophenyl)-8-methoxyquinolin-7-yl]acetamide?
The IUPAC name of N-[4-(3-acetamidophenyl)-8-methoxyquinolin-7-yl]acetamide (CID 155168993) is N-[4-(3-acetamidophenyl)-8-methoxyquinolin-7-yl]acetamide.
What is the SMILES notation for N-[4-(3-acetamidophenyl)-8-methoxyquinolin-7-yl]acetamide?
The canonical SMILES for N-[4-(3-acetamidophenyl)-8-methoxyquinolin-7-yl]acetamide is COc1c(NC(C)=O)ccc2c(-c3cccc(NC(C)=O)c3)ccnc12.
What is the InChIKey of N-[4-(3-acetamidophenyl)-8-methoxyquinolin-7-yl]acetamide?
The InChIKey is GCDSEGMAIKYCQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O3/c1-12(24)22-15-6-4-5-14(11-15)16-9-10-21-19-17(16)7-8-18(20(19)26-3)23-13(2)25/h4-11H,1-3H3,(H,22,24)(H,23,25).
What are the key properties of N-[4-(3-acetamidophenyl)-8-methoxyquinolin-7-yl]acetamide?
N-[4-(3-acetamidophenyl)-8-methoxyquinolin-7-yl]acetamide has a molecular weight of 349.39 g/mol, XLogP of 3.83, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3-acetamidophenyl)-8-methoxyquinolin-7-yl]acetamide is sourced from PubChem (CID 155168993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).