N-[(2-oxo-1H-quinolin-3-yl)methyl]-2-(5-phenyl-1,2-oxazol-3-yl)acetamide

C21H17N3O3 — CID 110619588

IUPACN-[(2-oxo-1H-quinolin-3-yl)methyl]-2-(5-phenyl-1,2-oxazol-3-yl)acetamide
SMILESO=C(Cc1cc(-c2ccccc2)on1)NCc1cc2ccccc2[nH]c1=O
InChIInChI=1S/C21H17N3O3/c25-20(12-17-11-19(27-24-17)14-6-2-1-3-7-14)22-13-16-10-15-8-4-5-9-18(15)23-21(16)26/h1-11H,12-13H2,(H,22,25)(H,23,26)
InChIKeyQJUNGZSNIXQOGY-UHFFFAOYSA-N
MW359.39 g/mol
LogP3.04
Rot. Bonds5

About N-[(2-oxo-1H-quinolin-3-yl)methyl]-2-(5-phenyl-1,2-oxazol-3-yl)acetamide

N-[(2-oxo-1H-quinolin-3-yl)methyl]-2-(5-phenyl-1,2-oxazol-3-yl)acetamide (PubChem CID 110619588) has the molecular formula C21H17N3O3 and a molecular weight of 359.39 g/mol. Its IUPAC name is N-[(2-oxo-1H-quinolin-3-yl)methyl]-2-(5-phenyl-1,2-oxazol-3-yl)acetamide.

Molecular Properties

Compound NameN-[(2-oxo-1H-quinolin-3-yl)methyl]-2-(5-phenyl-1,2-oxazol-3-yl)acetamide
PubChem CID110619588
Molecular FormulaC21H17N3O3
Molecular Weight359.39 g/mol
Exact Mass359.13
IUPAC NameN-[(2-oxo-1H-quinolin-3-yl)methyl]-2-(5-phenyl-1,2-oxazol-3-yl)acetamide
SMILESO=C(Cc1cc(-c2ccccc2)on1)NCc1cc2ccccc2[nH]c1=O
InChIInChI=1S/C21H17N3O3/c25-20(12-17-11-19(27-24-17)14-6-2-1-3-7-14)22-13-16-10-15-8-4-5-9-18(15)23-21(16)26/h1-11H,12-13H2,(H,22,25)(H,23,26)
InChIKeyQJUNGZSNIXQOGY-UHFFFAOYSA-N
XLogP3.04
TPSA87.99 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.39
LogP ≤ 53.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2-oxo-1H-quinolin-3-yl)methyl]-5-phenyl-1,2-oxazole-3-carboxamide
CID 110619586
5-(3-methoxyphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]-1,2-oxazole-3-carboxamide
CID 110619594
2-phenyl-N-[(5-phenyl-1,2-oxazol-3-yl)methyl]acetamide
CID 16866545
N-[(2-oxo-1H-quinolin-3-yl)methyl]-3-phenylbenzamide
CID 110324311
N-[(2-oxo-1H-quinolin-3-yl)methyl]-3-(4-phenyl-1,3-thiazol-2-yl)propanamide
CID 110608858
2-(4-oxo-3H-phthalazin-1-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]acetamide
CID 139017463
N-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-2-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 110608950
2-[5-methyl-2-(2-methylphenyl)-1,3-oxazol-4-yl]-N-[(2-oxo-1H-quinolin-3-yl)methyl]acetamide
CID 110608808
2-(3-methyl-2-oxo-1H-quinolin-6-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]acetamide
CID 110616680
N-[(2-oxo-1H-quinolin-3-yl)methyl]-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
CID 110608823
N-[[5-(4-methylphenyl)-1,2-oxazol-3-yl]methyl]-2-naphthalen-1-ylacetamide
CID 16866680
N-[(2R)-2-hydroxy-3-phenylpropyl]-2-(5-phenyl-1,2-oxazol-3-yl)acetamide
CID 97227511

Frequently Asked Questions

What is the IUPAC name of N-[(2-oxo-1H-quinolin-3-yl)methyl]-2-(5-phenyl-1,2-oxazol-3-yl)acetamide?
The IUPAC name of N-[(2-oxo-1H-quinolin-3-yl)methyl]-2-(5-phenyl-1,2-oxazol-3-yl)acetamide (CID 110619588) is N-[(2-oxo-1H-quinolin-3-yl)methyl]-2-(5-phenyl-1,2-oxazol-3-yl)acetamide.
What is the SMILES notation for N-[(2-oxo-1H-quinolin-3-yl)methyl]-2-(5-phenyl-1,2-oxazol-3-yl)acetamide?
The canonical SMILES for N-[(2-oxo-1H-quinolin-3-yl)methyl]-2-(5-phenyl-1,2-oxazol-3-yl)acetamide is O=C(Cc1cc(-c2ccccc2)on1)NCc1cc2ccccc2[nH]c1=O.
What is the InChIKey of N-[(2-oxo-1H-quinolin-3-yl)methyl]-2-(5-phenyl-1,2-oxazol-3-yl)acetamide?
The InChIKey is QJUNGZSNIXQOGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17N3O3/c25-20(12-17-11-19(27-24-17)14-6-2-1-3-7-14)22-13-16-10-15-8-4-5-9-18(15)23-21(16)26/h1-11H,12-13H2,(H,22,25)(H,23,26).
What are the key properties of N-[(2-oxo-1H-quinolin-3-yl)methyl]-2-(5-phenyl-1,2-oxazol-3-yl)acetamide?
N-[(2-oxo-1H-quinolin-3-yl)methyl]-2-(5-phenyl-1,2-oxazol-3-yl)acetamide has a molecular weight of 359.39 g/mol, XLogP of 3.04, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-oxo-1H-quinolin-3-yl)methyl]-2-(5-phenyl-1,2-oxazol-3-yl)acetamide is sourced from PubChem (CID 110619588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).