N-[(Z)-1-phenylethylideneamino]-4-propan-2-yloxybenzamide

C18H20N2O2 — CID 9215513

IUPACN-[(Z)-1-phenylethylideneamino]-4-propan-2-yloxybenzamide
SMILESC/C(=N/NC(=O)c1ccc(OC(C)C)cc1)c1ccccc1
InChIInChI=1S/C18H20N2O2/c1-13(2)22-17-11-9-16(10-12-17)18(21)20-19-14(3)15-7-5-4-6-8-15/h4-13H,1-3H3,(H,20,21)/b19-14-
InChIKeyVIGHOKLHIXQAOK-RGEXLXHISA-N
MW296.37 g/mol
LogP3.63
Rot. Bonds5

About N-[(Z)-1-phenylethylideneamino]-4-propan-2-yloxybenzamide

N-[(Z)-1-phenylethylideneamino]-4-propan-2-yloxybenzamide (PubChem CID 9215513) has the molecular formula C18H20N2O2 and a molecular weight of 296.37 g/mol. Its IUPAC name is N-[(Z)-1-phenylethylideneamino]-4-propan-2-yloxybenzamide.

Molecular Properties

Compound NameN-[(Z)-1-phenylethylideneamino]-4-propan-2-yloxybenzamide
PubChem CID9215513
Molecular FormulaC18H20N2O2
Molecular Weight296.37 g/mol
Exact Mass296.15
IUPAC NameN-[(Z)-1-phenylethylideneamino]-4-propan-2-yloxybenzamide
SMILESC/C(=N/NC(=O)c1ccc(OC(C)C)cc1)c1ccccc1
InChIInChI=1S/C18H20N2O2/c1-13(2)22-17-11-9-16(10-12-17)18(21)20-19-14(3)15-7-5-4-6-8-15/h4-13H,1-3H3,(H,20,21)/b19-14-
InChIKeyVIGHOKLHIXQAOK-RGEXLXHISA-N
XLogP3.63
TPSA50.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-[(Z)-1-phenylethylideneamino]-4-propan-2-yloxybenzamide 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-[(Z)-1-[4-(dimethylamino)phenyl]ethylideneamino]-4-propan-2-yloxybenzamide
CID 9215396
N-[(Z)-1-(4-phenoxyphenyl)ethylideneamino]benzamide
CID 5418111
N-[(Z)-1-(3-acetamidophenyl)ethylideneamino]-4-propan-2-yloxybenzamide
CID 9215676
4-(2-methylpropoxy)-N-(1-phenylethylideneamino)benzamide
CID 4929975
2-[3-[(Z)-C-methyl-N-[(4-propan-2-yloxybenzoyl)amino]carbonimidoyl]phenoxy]acetic acid
CID 9215286
4-propan-2-yloxy-N-[(Z)-1-pyridin-2-ylethylideneamino]benzamide
CID 9215537
N-[1-(4-ethoxyphenyl)ethylideneamino]benzamide
CID 912000
4-benzamido-N-[1-(4-methoxyphenyl)ethylideneamino]benzamide
CID 3289478
3,4,5-trimethoxy-N-[(Z)-1-(4-propan-2-yloxyphenyl)ethylideneamino]benzamide
CID 9231843
N-[(Z)-1-(4-methoxyphenyl)ethylideneamino]-4-phenylbenzamide
CID 5496134
N-[(E)-1-phenylethylideneamino]-4-prop-2-enoxybenzamide
CID 6232405
N-[(Z)-1-(2,4-difluorophenyl)ethylideneamino]-4-propan-2-yloxybenzamide
CID 9215314

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-1-phenylethylideneamino]-4-propan-2-yloxybenzamide?
The IUPAC name of N-[(Z)-1-phenylethylideneamino]-4-propan-2-yloxybenzamide (CID 9215513) is N-[(Z)-1-phenylethylideneamino]-4-propan-2-yloxybenzamide.
What is the SMILES notation for N-[(Z)-1-phenylethylideneamino]-4-propan-2-yloxybenzamide?
The canonical SMILES for N-[(Z)-1-phenylethylideneamino]-4-propan-2-yloxybenzamide is C/C(=N/NC(=O)c1ccc(OC(C)C)cc1)c1ccccc1.
What is the InChIKey of N-[(Z)-1-phenylethylideneamino]-4-propan-2-yloxybenzamide?
The InChIKey is VIGHOKLHIXQAOK-RGEXLXHISA-N. The full InChI is InChI=1S/C18H20N2O2/c1-13(2)22-17-11-9-16(10-12-17)18(21)20-19-14(3)15-7-5-4-6-8-15/h4-13H,1-3H3,(H,20,21)/b19-14-.
What are the key properties of N-[(Z)-1-phenylethylideneamino]-4-propan-2-yloxybenzamide?
N-[(Z)-1-phenylethylideneamino]-4-propan-2-yloxybenzamide has a molecular weight of 296.37 g/mol, XLogP of 3.63, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-1-phenylethylideneamino]-4-propan-2-yloxybenzamide is sourced from PubChem (CID 9215513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).