N-[2-[(4-hydroxybenzoyl)amino]ethyl]quinoline-8-carboxamide

C19H17N3O3 — CID 60517244

IUPACN-[2-[(4-hydroxybenzoyl)amino]ethyl]quinoline-8-carboxamide
SMILESO=C(NCCNC(=O)c1cccc2cccnc12)c1ccc(O)cc1
InChIInChI=1S/C19H17N3O3/c23-15-8-6-14(7-9-15)18(24)21-11-12-22-19(25)16-5-1-3-13-4-2-10-20-17(13)16/h1-10,23H,11-12H2,(H,21,24)(H,22,25)
InChIKeyICFYDFICWJDCKB-UHFFFAOYSA-N
MW335.36 g/mol
LogP2.10
Rot. Bonds5

About N-[2-[(4-hydroxybenzoyl)amino]ethyl]quinoline-8-carboxamide

N-[2-[(4-hydroxybenzoyl)amino]ethyl]quinoline-8-carboxamide (PubChem CID 60517244) has the molecular formula C19H17N3O3 and a molecular weight of 335.36 g/mol. Its IUPAC name is N-[2-[(4-hydroxybenzoyl)amino]ethyl]quinoline-8-carboxamide.

Molecular Properties

Compound NameN-[2-[(4-hydroxybenzoyl)amino]ethyl]quinoline-8-carboxamide
PubChem CID60517244
Molecular FormulaC19H17N3O3
Molecular Weight335.36 g/mol
Exact Mass335.13
IUPAC NameN-[2-[(4-hydroxybenzoyl)amino]ethyl]quinoline-8-carboxamide
SMILESO=C(NCCNC(=O)c1cccc2cccnc12)c1ccc(O)cc1
InChIInChI=1S/C19H17N3O3/c23-15-8-6-14(7-9-15)18(24)21-11-12-22-19(25)16-5-1-3-13-4-2-10-20-17(13)16/h1-10,23H,11-12H2,(H,21,24)(H,22,25)
InChIKeyICFYDFICWJDCKB-UHFFFAOYSA-N
XLogP2.10
TPSA91.32 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.36
LogP ≤ 52.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-(cyclopropylamino)ethyl]quinoline-8-carboxamide
CID 55126983
N-[(2-hydroxyphenyl)methyl]quinoline-8-carboxamide
CID 115598832
N-(2-hydroxy-2-methylpropyl)quinoline-8-carboxamide
CID 65109650
N-[2-(4-methoxyphenoxy)ethyl]quinoline-8-carboxamide
CID 51232751
N-[2-[(8-bromoquinolin-2-yl)amino]ethyl]-4-hydroxybenzamide
CID 133370340
2-chloro-N-[2-[(4-chlorobenzoyl)amino]ethyl]pyridine-3-carboxamide
CID 34990121
N-(2-morpholin-4-ylethyl)quinoline-8-carboxamide
CID 30370396
N-pyrimidin-2-ylquinoline-8-carboxamide
CID 175780986
N-(3-amino-2-hydroxy-3-oxopropyl)quinoline-8-carboxamide
CID 106165340
N-(2-benzamidoethyl)-2-chloropyridine-3-carboxamide
CID 38202326
N-[3-(furan-2-ylmethoxy)propyl]quinoline-8-carboxamide
CID 51296890
N-[2-(methylamino)propyl]quinoline-8-carboxamide;dihydrochloride
CID 120829987

Frequently Asked Questions

What is the IUPAC name of N-[2-[(4-hydroxybenzoyl)amino]ethyl]quinoline-8-carboxamide?
The IUPAC name of N-[2-[(4-hydroxybenzoyl)amino]ethyl]quinoline-8-carboxamide (CID 60517244) is N-[2-[(4-hydroxybenzoyl)amino]ethyl]quinoline-8-carboxamide.
What is the SMILES notation for N-[2-[(4-hydroxybenzoyl)amino]ethyl]quinoline-8-carboxamide?
The canonical SMILES for N-[2-[(4-hydroxybenzoyl)amino]ethyl]quinoline-8-carboxamide is O=C(NCCNC(=O)c1cccc2cccnc12)c1ccc(O)cc1.
What is the InChIKey of N-[2-[(4-hydroxybenzoyl)amino]ethyl]quinoline-8-carboxamide?
The InChIKey is ICFYDFICWJDCKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O3/c23-15-8-6-14(7-9-15)18(24)21-11-12-22-19(25)16-5-1-3-13-4-2-10-20-17(13)16/h1-10,23H,11-12H2,(H,21,24)(H,22,25).
What are the key properties of N-[2-[(4-hydroxybenzoyl)amino]ethyl]quinoline-8-carboxamide?
N-[2-[(4-hydroxybenzoyl)amino]ethyl]quinoline-8-carboxamide has a molecular weight of 335.36 g/mol, XLogP of 2.10, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(4-hydroxybenzoyl)amino]ethyl]quinoline-8-carboxamide is sourced from PubChem (CID 60517244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).