N-[3-(2-amino-2-oxoethoxy)phenyl]-2-oxo-1H-quinoline-4-carboxamide

C18H15N3O4 — CID 18290394

IUPACN-[3-(2-amino-2-oxoethoxy)phenyl]-2-oxo-1H-quinoline-4-carboxamide
SMILESNC(=O)COc1cccc(NC(=O)c2cc(=O)[nH]c3ccccc23)c1
InChIInChI=1S/C18H15N3O4/c19-16(22)10-25-12-5-3-4-11(8-12)20-18(24)14-9-17(23)21-15-7-2-1-6-13(14)15/h1-9H,10H2,(H2,19,22)(H,20,24)(H,21,23)
InChIKeyRGSIVRHOPVHRRD-UHFFFAOYSA-N
MW337.34 g/mol
LogP1.64
Rot. Bonds5

About N-[3-(2-amino-2-oxoethoxy)phenyl]-2-oxo-1H-quinoline-4-carboxamide

N-[3-(2-amino-2-oxoethoxy)phenyl]-2-oxo-1H-quinoline-4-carboxamide (PubChem CID 18290394) has the molecular formula C18H15N3O4 and a molecular weight of 337.34 g/mol. Its IUPAC name is N-[3-(2-amino-2-oxoethoxy)phenyl]-2-oxo-1H-quinoline-4-carboxamide.

Molecular Properties

Compound NameN-[3-(2-amino-2-oxoethoxy)phenyl]-2-oxo-1H-quinoline-4-carboxamide
PubChem CID18290394
Molecular FormulaC18H15N3O4
Molecular Weight337.34 g/mol
Exact Mass337.11
IUPAC NameN-[3-(2-amino-2-oxoethoxy)phenyl]-2-oxo-1H-quinoline-4-carboxamide
SMILESNC(=O)COc1cccc(NC(=O)c2cc(=O)[nH]c3ccccc23)c1
InChIInChI=1S/C18H15N3O4/c19-16(22)10-25-12-5-3-4-11(8-12)20-18(24)14-9-17(23)21-15-7-2-1-6-13(14)15/h1-9H,10H2,(H2,19,22)(H,20,24)(H,21,23)
InChIKeyRGSIVRHOPVHRRD-UHFFFAOYSA-N
XLogP1.64
TPSA114.28 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.34
LogP ≤ 51.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-carbamoylphenyl)-2-oxo-1H-quinoline-4-carboxamide
CID 8840546
N-[4-[2-(dimethylamino)-2-oxoethoxy]phenyl]-2-oxo-1H-quinoline-4-carboxamide
CID 32943769
N-[3-(2-amino-2-oxoethoxy)phenyl]-2-pyridin-4-ylquinoline-4-carboxamide
CID 43048343
2-oxo-1H-quinoline-4-carbohydrazide
CID 676699
N-[3-(2-amino-2-oxoethoxy)phenyl]-2-cyclopropyl-1H-pyrrole-3-carboxamide
CID 136541201
[2-(4-nitrophenyl)-2-oxoethyl] 3-[(2-oxo-1H-quinoline-4-carbonyl)amino]benzoate
CID 1128716
N-[3-(2-amino-2-oxoethoxy)phenyl]-2,4-dichloro-5-fluorobenzamide
CID 18155447
2-oxo-N-[4-(trifluoromethyl)phenyl]-1H-quinoline-4-carboxamide
CID 17391109
N-[3-(2-amino-2-oxoethoxy)phenyl]thiophene-2-carboxamide
CID 46529043
N-(2-methoxyphenyl)-2-oxo-1H-quinoline-4-carboxamide
CID 917217
[1-(3-methoxyanilino)-1-oxopropan-2-yl] 2-oxo-1H-quinoline-4-carboxylate
CID 42901293
N-[3-(2-amino-2-oxoethoxy)phenyl]-3-oxobutanamide
CID 61251264

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-amino-2-oxoethoxy)phenyl]-2-oxo-1H-quinoline-4-carboxamide?
The IUPAC name of N-[3-(2-amino-2-oxoethoxy)phenyl]-2-oxo-1H-quinoline-4-carboxamide (CID 18290394) is N-[3-(2-amino-2-oxoethoxy)phenyl]-2-oxo-1H-quinoline-4-carboxamide.
What is the SMILES notation for N-[3-(2-amino-2-oxoethoxy)phenyl]-2-oxo-1H-quinoline-4-carboxamide?
The canonical SMILES for N-[3-(2-amino-2-oxoethoxy)phenyl]-2-oxo-1H-quinoline-4-carboxamide is NC(=O)COc1cccc(NC(=O)c2cc(=O)[nH]c3ccccc23)c1.
What is the InChIKey of N-[3-(2-amino-2-oxoethoxy)phenyl]-2-oxo-1H-quinoline-4-carboxamide?
The InChIKey is RGSIVRHOPVHRRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3O4/c19-16(22)10-25-12-5-3-4-11(8-12)20-18(24)14-9-17(23)21-15-7-2-1-6-13(14)15/h1-9H,10H2,(H2,19,22)(H,20,24)(H,21,23).
What are the key properties of N-[3-(2-amino-2-oxoethoxy)phenyl]-2-oxo-1H-quinoline-4-carboxamide?
N-[3-(2-amino-2-oxoethoxy)phenyl]-2-oxo-1H-quinoline-4-carboxamide has a molecular weight of 337.34 g/mol, XLogP of 1.64, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-amino-2-oxoethoxy)phenyl]-2-oxo-1H-quinoline-4-carboxamide is sourced from PubChem (CID 18290394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).