N-[(E)-(2-hydroxyphenyl)methylideneamino]-2-(9-oxoacridin-10-yl)acetamide

C22H17N3O3 — CID 135683432

IUPACN-[(E)-(2-hydroxyphenyl)methylideneamino]-2-(9-oxoacridin-10-yl)acetamide
SMILESO=C(Cn1c2ccccc2c(=O)c2ccccc21)N/N=C/c1ccccc1O
InChIInChI=1S/C22H17N3O3/c26-20-12-6-1-7-15(20)13-23-24-21(27)14-25-18-10-4-2-8-16(18)22(28)17-9-3-5-11-19(17)25/h1-13,26H,14H2,(H,24,27)/b23-13+
InChIKeyBNTYZACFMSFKAP-YDZHTSKRSA-N
MW371.40 g/mol
LogP3.01
Rot. Bonds4

About N-[(E)-(2-hydroxyphenyl)methylideneamino]-2-(9-oxoacridin-10-yl)acetamide

N-[(E)-(2-hydroxyphenyl)methylideneamino]-2-(9-oxoacridin-10-yl)acetamide (PubChem CID 135683432) has the molecular formula C22H17N3O3 and a molecular weight of 371.40 g/mol. Its IUPAC name is N-[(E)-(2-hydroxyphenyl)methylideneamino]-2-(9-oxoacridin-10-yl)acetamide.

Molecular Properties

Compound NameN-[(E)-(2-hydroxyphenyl)methylideneamino]-2-(9-oxoacridin-10-yl)acetamide
PubChem CID135683432
Molecular FormulaC22H17N3O3
Molecular Weight371.40 g/mol
Exact Mass371.13
IUPAC NameN-[(E)-(2-hydroxyphenyl)methylideneamino]-2-(9-oxoacridin-10-yl)acetamide
SMILESO=C(Cn1c2ccccc2c(=O)c2ccccc21)N/N=C/c1ccccc1O
InChIInChI=1S/C22H17N3O3/c26-20-12-6-1-7-15(20)13-23-24-21(27)14-25-18-10-4-2-8-16(18)22(28)17-9-3-5-11-19(17)25/h1-13,26H,14H2,(H,24,27)/b23-13+
InChIKeyBNTYZACFMSFKAP-YDZHTSKRSA-N
XLogP3.01
TPSA83.69 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.40
LogP ≤ 53.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

N-(2-{[(2E)-2-(4-hydroxybenzylidene)hydrazinyl]carbonyl}phenyl)benzamide
CID 135625843
3-{[1-(2-hydroxyphenyl)ethylidene]amino}-2-phenyl-2,3-dihydro-4(1H)-quinazolinone
CID 135455117
N'-{(1E)-[3-(3,4-dihydroquinolin-1(2H)-ylmethyl)-4-methoxyphenyl]methylene}-4-hydroxybenzohydrazide
CID 9653411
N'-[(1E)-(2-hydroxyphenyl)methylidene]-2-(1,2,3,4-tetrahydroquinolin-1-yl)acetohydrazide
CID 135521563
N-[(E)-(2-hydroxyphenyl)methylideneamino]-4-oxo-1H-quinoline-3-carboxamide
CID 156015219
6-fluoro-N-[(E)-(2-hydroxyphenyl)methylideneamino]-4-oxo-1H-quinoline-3-carboxamide
CID 156016975
2-(3-benzyl-2-oxoquinoxalin-1-yl)-N-[(E)-(2-hydroxyphenyl)methylideneamino]acetamide
CID 164617873
N'-{(E)-[4-(diethylamino)-2-hydroxyphenyl]methylidene}-2-(9-oxoacridin-10(9H)-yl)acetohydrazide
CID 135489942
Centmitor-1
CID 135489933
1-ethyl-6-fluoro-N-[(E)-(2-hydroxyphenyl)methylideneamino]-4-oxo-7-piperazin-1-ylquinoline-3-carboxamide
CID 156015561
2-(9-oxoacridin-10(9H)-yl)-N'-[(E)-(5-phenylfuran-2-yl)methylidene]acetohydrazide
CID 9668726
N-(4-hydroxyphenyl)-2-(9-oxoacridin-10-yl)acetamide
CID 90676803

Frequently Asked Questions

What is the IUPAC name of N-[(E)-(2-hydroxyphenyl)methylideneamino]-2-(9-oxoacridin-10-yl)acetamide?
The IUPAC name of N-[(E)-(2-hydroxyphenyl)methylideneamino]-2-(9-oxoacridin-10-yl)acetamide (CID 135683432) is N-[(E)-(2-hydroxyphenyl)methylideneamino]-2-(9-oxoacridin-10-yl)acetamide.
What is the SMILES notation for N-[(E)-(2-hydroxyphenyl)methylideneamino]-2-(9-oxoacridin-10-yl)acetamide?
The canonical SMILES for N-[(E)-(2-hydroxyphenyl)methylideneamino]-2-(9-oxoacridin-10-yl)acetamide is O=C(Cn1c2ccccc2c(=O)c2ccccc21)N/N=C/c1ccccc1O.
What is the InChIKey of N-[(E)-(2-hydroxyphenyl)methylideneamino]-2-(9-oxoacridin-10-yl)acetamide?
The InChIKey is BNTYZACFMSFKAP-YDZHTSKRSA-N. The full InChI is InChI=1S/C22H17N3O3/c26-20-12-6-1-7-15(20)13-23-24-21(27)14-25-18-10-4-2-8-16(18)22(28)17-9-3-5-11-19(17)25/h1-13,26H,14H2,(H,24,27)/b23-13+.
What are the key properties of N-[(E)-(2-hydroxyphenyl)methylideneamino]-2-(9-oxoacridin-10-yl)acetamide?
N-[(E)-(2-hydroxyphenyl)methylideneamino]-2-(9-oxoacridin-10-yl)acetamide has a molecular weight of 371.40 g/mol, XLogP of 3.01, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-(2-hydroxyphenyl)methylideneamino]-2-(9-oxoacridin-10-yl)acetamide is sourced from PubChem (CID 135683432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).