2-phenyl-N-[(Z)-1-pyridin-3-ylethylideneamino]acetamide

C15H15N3O — CID 5414702

IUPAC2-phenyl-N-[(Z)-1-pyridin-3-ylethylideneamino]acetamide
SMILESC/C(=N/NC(=O)Cc1ccccc1)c1cccnc1
InChIInChI=1S/C15H15N3O/c1-12(14-8-5-9-16-11-14)17-18-15(19)10-13-6-3-2-4-7-13/h2-9,11H,10H2,1H3,(H,18,19)/b17-12-
InChIKeyOQJVMGPYIOGVHF-ATVHPVEESA-N
MW253.31 g/mol
LogP2.16
Rot. Bonds4

About 2-phenyl-N-[(Z)-1-pyridin-3-ylethylideneamino]acetamide

2-phenyl-N-[(Z)-1-pyridin-3-ylethylideneamino]acetamide (PubChem CID 5414702) has the molecular formula C15H15N3O and a molecular weight of 253.31 g/mol. Its IUPAC name is 2-phenyl-N-[(Z)-1-pyridin-3-ylethylideneamino]acetamide.

Molecular Properties

Compound Name2-phenyl-N-[(Z)-1-pyridin-3-ylethylideneamino]acetamide
PubChem CID5414702
Molecular FormulaC15H15N3O
Molecular Weight253.31 g/mol
Exact Mass253.12
IUPAC Name2-phenyl-N-[(Z)-1-pyridin-3-ylethylideneamino]acetamide
SMILESC/C(=N/NC(=O)Cc1ccccc1)c1cccnc1
InChIInChI=1S/C15H15N3O/c1-12(14-8-5-9-16-11-14)17-18-15(19)10-13-6-3-2-4-7-13/h2-9,11H,10H2,1H3,(H,18,19)/b17-12-
InChIKeyOQJVMGPYIOGVHF-ATVHPVEESA-N
XLogP2.16
TPSA54.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 52.16
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 2-phenyl-N-[(Z)-1-pyridin-3-ylethylideneamino]acetamide 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

2-(4-hydroxyphenyl)-N-(1-pyridin-3-ylethylideneamino)acetamide
CID 24818553
2-(4-bromophenyl)-N-[(E)-1-pyridin-3-ylethylideneamino]acetamide
CID 25237297
2-(4-benzylpiperazin-1-yl)-N-(1-pyridin-3-ylethylideneamino)acetamide
CID 1185544
2-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)-N-[(E)-1-pyridin-3-ylethylideneamino]acetamide
CID 5393103
[(Z)-1-pyridin-3-ylethylideneamino]urea
CID 5355222
N-(1-pyridin-3-ylethylideneamino)nonanamide
CID 5136280
N-(1-pyridin-3-ylethylideneamino)heptanamide
CID 4162270
2-(3-benzyl-6-oxo-2,5-dihydro-1H-1,2,4-triazin-5-yl)-N-[(E)-1-pyridin-3-ylethylideneamino]acetamide
CID 56692101
N-[(Z)-1-(4-ethylphenyl)ethylideneamino]-2-phenylacetamide
CID 6343025
N-[1-(4-bromophenyl)ethylideneamino]-2-phenylacetamide
CID 780756
(2R)-2-phenyl-N-[(Z)-1-pyridin-3-ylethylideneamino]butanamide
CID 26871484
2-phenyl-N-[(E)-1-pyridin-3-ylethylideneamino]butanamide
CID 25237434

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-N-[(Z)-1-pyridin-3-ylethylideneamino]acetamide?
The IUPAC name of 2-phenyl-N-[(Z)-1-pyridin-3-ylethylideneamino]acetamide (CID 5414702) is 2-phenyl-N-[(Z)-1-pyridin-3-ylethylideneamino]acetamide.
What is the SMILES notation for 2-phenyl-N-[(Z)-1-pyridin-3-ylethylideneamino]acetamide?
The canonical SMILES for 2-phenyl-N-[(Z)-1-pyridin-3-ylethylideneamino]acetamide is C/C(=N/NC(=O)Cc1ccccc1)c1cccnc1.
What is the InChIKey of 2-phenyl-N-[(Z)-1-pyridin-3-ylethylideneamino]acetamide?
The InChIKey is OQJVMGPYIOGVHF-ATVHPVEESA-N. The full InChI is InChI=1S/C15H15N3O/c1-12(14-8-5-9-16-11-14)17-18-15(19)10-13-6-3-2-4-7-13/h2-9,11H,10H2,1H3,(H,18,19)/b17-12-.
What are the key properties of 2-phenyl-N-[(Z)-1-pyridin-3-ylethylideneamino]acetamide?
2-phenyl-N-[(Z)-1-pyridin-3-ylethylideneamino]acetamide has a molecular weight of 253.31 g/mol, XLogP of 2.16, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-N-[(Z)-1-pyridin-3-ylethylideneamino]acetamide is sourced from PubChem (CID 5414702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).