N-[(E)-[phenyl(pyridin-2-yl)methylidene]amino]pyridin-2-amine

C17H14N4 — CID 6512079

IUPACN-[(E)-[phenyl(pyridin-2-yl)methylidene]amino]pyridin-2-amine
SMILESc1ccc(/C(=N\Nc2ccccn2)c2ccccn2)cc1
InChIInChI=1S/C17H14N4/c1-2-8-14(9-3-1)17(15-10-4-6-12-18-15)21-20-16-11-5-7-13-19-16/h1-13H,(H,19,20)/b21-17+
InChIKeyZFZHDOZUCPKKKI-HEHNFIMWSA-N
MW274.33 g/mol
LogP3.34
Rot. Bonds4

About N-[(E)-[phenyl(pyridin-2-yl)methylidene]amino]pyridin-2-amine

N-[(E)-[phenyl(pyridin-2-yl)methylidene]amino]pyridin-2-amine (PubChem CID 6512079) has the molecular formula C17H14N4 and a molecular weight of 274.33 g/mol. Its IUPAC name is N-[(E)-[phenyl(pyridin-2-yl)methylidene]amino]pyridin-2-amine.

Molecular Properties

Compound NameN-[(E)-[phenyl(pyridin-2-yl)methylidene]amino]pyridin-2-amine
PubChem CID6512079
Molecular FormulaC17H14N4
Molecular Weight274.33 g/mol
Exact Mass274.12
IUPAC NameN-[(E)-[phenyl(pyridin-2-yl)methylidene]amino]pyridin-2-amine
SMILESc1ccc(/C(=N\Nc2ccccn2)c2ccccn2)cc1
InChIInChI=1S/C17H14N4/c1-2-8-14(9-3-1)17(15-10-4-6-12-18-15)21-20-16-11-5-7-13-19-16/h1-13H,(H,19,20)/b21-17+
InChIKeyZFZHDOZUCPKKKI-HEHNFIMWSA-N
XLogP3.34
TPSA50.17 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.33
LogP ≤ 53.34
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'}

Analyze N-[(E)-[phenyl(pyridin-2-yl)methylidene]amino]pyridin-2-amine 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

5-nitro-N-[(Z)-[phenyl(pyridin-2-yl)methylidene]amino]pyridin-2-amine
CID 6035374
3-[(Z)-C-pyridin-2-yl-N-(pyridin-2-ylamino)carbonimidoyl]benzenesulfonic acid;dihydrate
CID 76845046
N'-(pyridin-2-ylamino)pyridine-2-carboximidamide
CID 139161473
3-fluoro-N-[(E)-[phenyl(pyridin-2-yl)methylidene]amino]pyridin-2-amine
CID 134463822
(NZ)-N-[phenyl(pyridin-2-yl)methylidene]hydroxylamine
CID 135427108
methyl N-[[phenyl(pyridin-2-yl)methylidene]amino]carbamate
CID 5103078
cerium(3+);tris(N-oxido-1-phenyl-1-pyridin-2-ylmethanimine)
CID 50910437
cerium(3+);tris((E)-N-oxido-1-phenyl-1-pyridin-2-ylmethanimine);chloride
CID 54608591
2-hydroxy-N-[(E)-[phenyl(pyridin-2-yl)methylidene]amino]benzamide
CID 6262559
2-hydroxy-2-phenyl-N-[(E)-[phenyl(pyridin-2-yl)methylidene]amino]acetamide
CID 6305283
chlorocopper;methyl N-[[phenyl(pyridin-2-yl)methylidene]amino]carbamodithioate
CID 50910622
1-ethyl-3-[(E)-[phenyl(pyridin-2-yl)methylidene]amino]thiourea
CID 6509755

Frequently Asked Questions

What is the IUPAC name of N-[(E)-[phenyl(pyridin-2-yl)methylidene]amino]pyridin-2-amine?
The IUPAC name of N-[(E)-[phenyl(pyridin-2-yl)methylidene]amino]pyridin-2-amine (CID 6512079) is N-[(E)-[phenyl(pyridin-2-yl)methylidene]amino]pyridin-2-amine.
What is the SMILES notation for N-[(E)-[phenyl(pyridin-2-yl)methylidene]amino]pyridin-2-amine?
The canonical SMILES for N-[(E)-[phenyl(pyridin-2-yl)methylidene]amino]pyridin-2-amine is c1ccc(/C(=N\Nc2ccccn2)c2ccccn2)cc1.
What is the InChIKey of N-[(E)-[phenyl(pyridin-2-yl)methylidene]amino]pyridin-2-amine?
The InChIKey is ZFZHDOZUCPKKKI-HEHNFIMWSA-N. The full InChI is InChI=1S/C17H14N4/c1-2-8-14(9-3-1)17(15-10-4-6-12-18-15)21-20-16-11-5-7-13-19-16/h1-13H,(H,19,20)/b21-17+.
What are the key properties of N-[(E)-[phenyl(pyridin-2-yl)methylidene]amino]pyridin-2-amine?
N-[(E)-[phenyl(pyridin-2-yl)methylidene]amino]pyridin-2-amine has a molecular weight of 274.33 g/mol, XLogP of 3.34, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-[phenyl(pyridin-2-yl)methylidene]amino]pyridin-2-amine is sourced from PubChem (CID 6512079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).