N-[(E)-(2-hydroxyphenyl)methylideneamino]-2-oxo-1H-quinoline-4-carboxamide

C17H13N3O3 — CID 135492206

IUPACN-[(E)-(2-hydroxyphenyl)methylideneamino]-2-oxo-1H-quinoline-4-carboxamide
SMILESO=C(N/N=C/c1ccccc1O)c1cc(=O)[nH]c2ccccc12
InChIInChI=1S/C17H13N3O3/c21-15-8-4-1-5-11(15)10-18-20-17(23)13-9-16(22)19-14-7-3-2-6-12(13)14/h1-10,21H,(H,19,22)(H,20,23)/b18-10+
InChIKeyLNPIXLAODUWSKY-VCHYOVAHSA-N
MW307.31 g/mol
LogP2.00
Rot. Bonds3

About N-[(E)-(2-hydroxyphenyl)methylideneamino]-2-oxo-1H-quinoline-4-carboxamide

N-[(E)-(2-hydroxyphenyl)methylideneamino]-2-oxo-1H-quinoline-4-carboxamide (PubChem CID 135492206) has the molecular formula C17H13N3O3 and a molecular weight of 307.31 g/mol. Its IUPAC name is N-[(E)-(2-hydroxyphenyl)methylideneamino]-2-oxo-1H-quinoline-4-carboxamide.

Molecular Properties

Compound NameN-[(E)-(2-hydroxyphenyl)methylideneamino]-2-oxo-1H-quinoline-4-carboxamide
PubChem CID135492206
Molecular FormulaC17H13N3O3
Molecular Weight307.31 g/mol
Exact Mass307.10
IUPAC NameN-[(E)-(2-hydroxyphenyl)methylideneamino]-2-oxo-1H-quinoline-4-carboxamide
SMILESO=C(N/N=C/c1ccccc1O)c1cc(=O)[nH]c2ccccc12
InChIInChI=1S/C17H13N3O3/c21-15-8-4-1-5-11(15)10-18-20-17(23)13-9-16(22)19-14-7-3-2-6-12(13)14/h1-10,21H,(H,19,22)(H,20,23)/b18-10+
InChIKeyLNPIXLAODUWSKY-VCHYOVAHSA-N
XLogP2.00
TPSA94.55 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.31
LogP ≤ 52.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-[(E)-(2-hydroxyphenyl)methylideneamino]-2-oxo-1H-quinoline-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(E)-(2-hydroxynaphthalen-1-yl)methylideneamino]-2-oxo-1H-quinoline-4-carboxamide
CID 135608103
N-[(Z)-(2-hydroxyphenyl)methylideneamino]-1H-indole-3-carboxamide
CID 136661289
N-(furan-2-ylmethylideneamino)-2-oxo-1H-quinoline-4-carboxamide
CID 2265467
N-[(E)-[4-(dimethylamino)phenyl]methylideneamino]-2-oxo-1H-quinoline-4-carboxamide
CID 5347000
N-[(Z)-(2-hydroxyphenyl)methylideneamino]-2-oxo-1H-pyridine-3-carboxamide
CID 137104191
N-[(E)-(5-bromo-2-hydroxyphenyl)methylideneamino]-1H-indole-3-carboxamide
CID 135541710
2-oxo-1H-quinoline-4-carbohydrazide
CID 676699
N-[(2-hydroxyphenyl)methylideneamino]-6-oxo-1H-pyrimidine-5-carboxamide
CID 3641500
4-bromo-2-hydroxy-N-[(E)-(2-hydroxyphenyl)methylideneamino]benzamide
CID 135511246
N-[(2-hydroxyphenyl)methylideneamino]-2-(methylamino)benzamide
CID 3596715
N-[(2-iodophenyl)methylideneamino]-1H-indole-3-carboxamide
CID 2165485
5-bromo-2-hydroxy-N-[(Z)-1H-indol-3-ylmethylideneamino]benzamide
CID 136711415

Frequently Asked Questions

What is the IUPAC name of N-[(E)-(2-hydroxyphenyl)methylideneamino]-2-oxo-1H-quinoline-4-carboxamide?
The IUPAC name of N-[(E)-(2-hydroxyphenyl)methylideneamino]-2-oxo-1H-quinoline-4-carboxamide (CID 135492206) is N-[(E)-(2-hydroxyphenyl)methylideneamino]-2-oxo-1H-quinoline-4-carboxamide.
What is the SMILES notation for N-[(E)-(2-hydroxyphenyl)methylideneamino]-2-oxo-1H-quinoline-4-carboxamide?
The canonical SMILES for N-[(E)-(2-hydroxyphenyl)methylideneamino]-2-oxo-1H-quinoline-4-carboxamide is O=C(N/N=C/c1ccccc1O)c1cc(=O)[nH]c2ccccc12.
What is the InChIKey of N-[(E)-(2-hydroxyphenyl)methylideneamino]-2-oxo-1H-quinoline-4-carboxamide?
The InChIKey is LNPIXLAODUWSKY-VCHYOVAHSA-N. The full InChI is InChI=1S/C17H13N3O3/c21-15-8-4-1-5-11(15)10-18-20-17(23)13-9-16(22)19-14-7-3-2-6-12(13)14/h1-10,21H,(H,19,22)(H,20,23)/b18-10+.
What are the key properties of N-[(E)-(2-hydroxyphenyl)methylideneamino]-2-oxo-1H-quinoline-4-carboxamide?
N-[(E)-(2-hydroxyphenyl)methylideneamino]-2-oxo-1H-quinoline-4-carboxamide has a molecular weight of 307.31 g/mol, XLogP of 2.00, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-(2-hydroxyphenyl)methylideneamino]-2-oxo-1H-quinoline-4-carboxamide is sourced from PubChem (CID 135492206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).