N-[(Z)-[4-(diethylamino)phenyl]methylideneamino]-3-methoxybenzamide

C19H23N3O2 — CID 6027249

IUPACN-[(Z)-[4-(diethylamino)phenyl]methylideneamino]-3-methoxybenzamide
SMILESCCN(CC)c1ccc(/C=N\NC(=O)c2cccc(OC)c2)cc1
InChIInChI=1S/C19H23N3O2/c1-4-22(5-2)17-11-9-15(10-12-17)14-20-21-19(23)16-7-6-8-18(13-16)24-3/h6-14H,4-5H2,1-3H3,(H,21,23)/b20-14-
InChIKeyJYHDLNXLFFFEHW-ZHZULCJRSA-N
MW325.41 g/mol
LogP3.31
Rot. Bonds7

About N-[(Z)-[4-(diethylamino)phenyl]methylideneamino]-3-methoxybenzamide

N-[(Z)-[4-(diethylamino)phenyl]methylideneamino]-3-methoxybenzamide (PubChem CID 6027249) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is N-[(Z)-[4-(diethylamino)phenyl]methylideneamino]-3-methoxybenzamide.

Molecular Properties

Compound NameN-[(Z)-[4-(diethylamino)phenyl]methylideneamino]-3-methoxybenzamide
PubChem CID6027249
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC NameN-[(Z)-[4-(diethylamino)phenyl]methylideneamino]-3-methoxybenzamide
SMILESCCN(CC)c1ccc(/C=N\NC(=O)c2cccc(OC)c2)cc1
InChIInChI=1S/C19H23N3O2/c1-4-22(5-2)17-11-9-15(10-12-17)14-20-21-19(23)16-7-6-8-18(13-16)24-3/h6-14H,4-5H2,1-3H3,(H,21,23)/b20-14-
InChIKeyJYHDLNXLFFFEHW-ZHZULCJRSA-N
XLogP3.31
TPSA53.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 53.31
H-Bond Donors ≤ 51
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

N-[(Z)-[4-(diethylamino)phenyl]methylideneamino]-4-methoxybenzamide
CID 5372104
N-(benzylideneamino)-3-methoxybenzamide
CID 3517169
N-[[4-(diethylamino)phenyl]methylideneamino]-3,4-dimethoxybenzamide
CID 2330939
N-[(Z)-[4-[benzyl(ethyl)amino]phenyl]methylideneamino]-3,5-dimethoxybenzamide
CID 7966329
N-[(E)-[4-(diethylamino)phenyl]methylideneamino]naphthalene-2-carboxamide
CID 6882997
[4-[(Z)-[(3-methoxybenzoyl)hydrazinylidene]methyl]phenyl] acetate
CID 124605345
N-[(3,4-dihydroxyphenyl)methylideneamino]-3-methoxybenzamide
CID 4056523
N-[(Z)-[4-(2-amino-2-oxoethoxy)phenyl]methylideneamino]-3-methoxybenzamide
CID 5412030
N-[(3,4-dichlorophenyl)methylideneamino]-3-methoxybenzamide
CID 5069524
N-[(Z)-[4-(diethylamino)phenyl]methylideneamino]-4-hydroxybenzamide
CID 5410903
4-N-[(E)-[4-(diethylamino)phenyl]methylideneamino]benzene-1,4-dicarboxamide
CID 164880526
N-[(Z)-[4-(4-chlorophenyl)sulfanylphenyl]methylideneamino]-3-methoxybenzamide
CID 126110640

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-[4-(diethylamino)phenyl]methylideneamino]-3-methoxybenzamide?
The IUPAC name of N-[(Z)-[4-(diethylamino)phenyl]methylideneamino]-3-methoxybenzamide (CID 6027249) is N-[(Z)-[4-(diethylamino)phenyl]methylideneamino]-3-methoxybenzamide.
What is the SMILES notation for N-[(Z)-[4-(diethylamino)phenyl]methylideneamino]-3-methoxybenzamide?
The canonical SMILES for N-[(Z)-[4-(diethylamino)phenyl]methylideneamino]-3-methoxybenzamide is CCN(CC)c1ccc(/C=N\NC(=O)c2cccc(OC)c2)cc1.
What is the InChIKey of N-[(Z)-[4-(diethylamino)phenyl]methylideneamino]-3-methoxybenzamide?
The InChIKey is JYHDLNXLFFFEHW-ZHZULCJRSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-4-22(5-2)17-11-9-15(10-12-17)14-20-21-19(23)16-7-6-8-18(13-16)24-3/h6-14H,4-5H2,1-3H3,(H,21,23)/b20-14-.
What are the key properties of N-[(Z)-[4-(diethylamino)phenyl]methylideneamino]-3-methoxybenzamide?
N-[(Z)-[4-(diethylamino)phenyl]methylideneamino]-3-methoxybenzamide has a molecular weight of 325.41 g/mol, XLogP of 3.31, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-[4-(diethylamino)phenyl]methylideneamino]-3-methoxybenzamide is sourced from PubChem (CID 6027249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).