N-[(E)-1-[4-(diethylamino)phenyl]ethylideneamino]-4-hydroxybenzamide

C19H23N3O2 — CID 11404599

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

About N-[(E)-1-[4-(diethylamino)phenyl]ethylideneamino]-4-hydroxybenzamide

N-[(E)-1-[4-(diethylamino)phenyl]ethylideneamino]-4-hydroxybenzamide (PubChem CID 11404599) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is N-[(E)-1-[4-(diethylamino)phenyl]ethylideneamino]-4-hydroxybenzamide.

Molecular Properties

Compound NameN-[(E)-1-[4-(diethylamino)phenyl]ethylideneamino]-4-hydroxybenzamide
PubChem CID11404599
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC NameN-[(E)-1-[4-(diethylamino)phenyl]ethylideneamino]-4-hydroxybenzamide
SMILESCCN(CC)c1ccc(/C(C)=N/NC(=O)c2ccc(O)cc2)cc1
InChIInChI=1S/C19H23N3O2/c1-4-22(5-2)17-10-6-15(7-11-17)14(3)20-21-19(24)16-8-12-18(23)13-9-16/h6-13,23H,4-5H2,1-3H3,(H,21,24)/b20-14+
InChIKeyCCIJBOQESPRHPT-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': '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
3-[4-(Dimethylamino)phenyl]-1-(4-hydroxyphenyl)prop-2-en-1-one
CID 5468166
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-(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-hydroxy-N-[(E)-(4-morpholin-4-ylphenyl)methylideneamino]benzamide
CID 6906421
4-[(4-hydroxyanilino)methyl]-1(2H)-phthalazinone
CID 1482943
N'-{(E)-[4-(dimethylamino)phenyl]methylidene}-4-hydroxybenzohydrazide
CID 6864965

Frequently Asked Questions

What is the IUPAC name of N-[(E)-1-[4-(diethylamino)phenyl]ethylideneamino]-4-hydroxybenzamide?
The IUPAC name of N-[(E)-1-[4-(diethylamino)phenyl]ethylideneamino]-4-hydroxybenzamide (CID 11404599) is N-[(E)-1-[4-(diethylamino)phenyl]ethylideneamino]-4-hydroxybenzamide.
What is the SMILES notation for N-[(E)-1-[4-(diethylamino)phenyl]ethylideneamino]-4-hydroxybenzamide?
The canonical SMILES for N-[(E)-1-[4-(diethylamino)phenyl]ethylideneamino]-4-hydroxybenzamide is CCN(CC)c1ccc(/C(C)=N/NC(=O)c2ccc(O)cc2)cc1.
What is the InChIKey of N-[(E)-1-[4-(diethylamino)phenyl]ethylideneamino]-4-hydroxybenzamide?
The InChIKey is CCIJBOQESPRHPT-XSFVSMFZSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-4-22(5-2)17-10-6-15(7-11-17)14(3)20-21-19(24)16-8-12-18(23)13-9-16/h6-13,23H,4-5H2,1-3H3,(H,21,24)/b20-14+.
What are the key properties of N-[(E)-1-[4-(diethylamino)phenyl]ethylideneamino]-4-hydroxybenzamide?
N-[(E)-1-[4-(diethylamino)phenyl]ethylideneamino]-4-hydroxybenzamide 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 N-[(E)-1-[4-(diethylamino)phenyl]ethylideneamino]-4-hydroxybenzamide is sourced from PubChem (CID 11404599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).