4-(diethylamino)-N-[(E)-1-(4-hydroxyphenyl)ethylideneamino]benzamide

C19H23N3O2 — CID 135521630

IUPAC4-(diethylamino)-N-[(E)-1-(4-hydroxyphenyl)ethylideneamino]benzamide
SMILESCCN(CC)c1ccc(C(=O)N/N=C(\C)c2ccc(O)cc2)cc1
InChIInChI=1S/C19H23N3O2/c1-4-22(5-2)17-10-6-16(7-11-17)19(24)21-20-14(3)15-8-12-18(23)13-9-15/h6-13,23H,4-5H2,1-3H3,(H,21,24)/b20-14+
InChIKeyHFECGJUKVOVOJL-XSFVSMFZSA-N
MW325.41 g/mol
LogP3.39
Rot. Bonds6

About 4-(diethylamino)-N-[(E)-1-(4-hydroxyphenyl)ethylideneamino]benzamide

4-(diethylamino)-N-[(E)-1-(4-hydroxyphenyl)ethylideneamino]benzamide (PubChem CID 135521630) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is 4-(diethylamino)-N-[(E)-1-(4-hydroxyphenyl)ethylideneamino]benzamide.

Molecular Properties

Compound Name4-(diethylamino)-N-[(E)-1-(4-hydroxyphenyl)ethylideneamino]benzamide
PubChem CID135521630
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC Name4-(diethylamino)-N-[(E)-1-(4-hydroxyphenyl)ethylideneamino]benzamide
SMILESCCN(CC)c1ccc(C(=O)N/N=C(\C)c2ccc(O)cc2)cc1
InChIInChI=1S/C19H23N3O2/c1-4-22(5-2)17-10-6-16(7-11-17)19(24)21-20-14(3)15-8-12-18(23)13-9-15/h6-13,23H,4-5H2,1-3H3,(H,21,24)/b20-14+
InChIKeyHFECGJUKVOVOJL-XSFVSMFZSA-N
XLogP3.39
TPSA64.93 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 53.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_B(215)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

Gsk-9089
CID 5497124
n'-(4-(Diethylamino)-2-hydroxybenzylidene)-2-hydroxybenzohydrazide
CID 135472454
4-Aminobenzoic (2-hydroxybenzylidene)hydrazide
CID 135408682
Acyl Hydrazone, 10
CID 11404599
N-[[4-(diethylamino)phenyl]methylideneamino]-4-hydroxybenzamide
CID 644030
N-(4-{[2-(3-hydroxybenzylidene)hydrazino]carbonyl}phenyl)cyclohexanecarboxamide
CID 6875721
N-{4-[N-(2-hydroxybenzoyl)ethanehydrazonoyl]phenyl}benzamide
CID 9694778
N-(4-{[2-(2,4-dihydroxybenzylidene)hydrazino]carbonyl}phenyl)cyclohexanecarboxamide
CID 135418715
N-(2-{[(2E)-2-(4-hydroxybenzylidene)hydrazinyl]carbonyl}phenyl)benzamide
CID 135625843
Benzamide, 4-methyl-N-[3-(4-hydroxybenzylidenhydrazinocarbonyl)phenyl]-
CID 135419955
2-Hydroxy-4-diethylaminobenzaldehyde 4-tert-butyl-benzoyl hydrazone
CID 135470886
4-(2-Oxo-pyrrolidin-1-yl)-benzoic acid (4-methoxy-benzylidene)-hydrazide
CID 5331402

Frequently Asked Questions

What is the IUPAC name of 4-(diethylamino)-N-[(E)-1-(4-hydroxyphenyl)ethylideneamino]benzamide?
The IUPAC name of 4-(diethylamino)-N-[(E)-1-(4-hydroxyphenyl)ethylideneamino]benzamide (CID 135521630) is 4-(diethylamino)-N-[(E)-1-(4-hydroxyphenyl)ethylideneamino]benzamide.
What is the SMILES notation for 4-(diethylamino)-N-[(E)-1-(4-hydroxyphenyl)ethylideneamino]benzamide?
The canonical SMILES for 4-(diethylamino)-N-[(E)-1-(4-hydroxyphenyl)ethylideneamino]benzamide is CCN(CC)c1ccc(C(=O)N/N=C(\C)c2ccc(O)cc2)cc1.
What is the InChIKey of 4-(diethylamino)-N-[(E)-1-(4-hydroxyphenyl)ethylideneamino]benzamide?
The InChIKey is HFECGJUKVOVOJL-XSFVSMFZSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-4-22(5-2)17-10-6-16(7-11-17)19(24)21-20-14(3)15-8-12-18(23)13-9-15/h6-13,23H,4-5H2,1-3H3,(H,21,24)/b20-14+.
What are the key properties of 4-(diethylamino)-N-[(E)-1-(4-hydroxyphenyl)ethylideneamino]benzamide?
4-(diethylamino)-N-[(E)-1-(4-hydroxyphenyl)ethylideneamino]benzamide has a molecular weight of 325.41 g/mol, XLogP of 3.39, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(diethylamino)-N-[(E)-1-(4-hydroxyphenyl)ethylideneamino]benzamide is sourced from PubChem (CID 135521630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).