N-[(2,4-dichlorophenyl)methylideneamino]-N'-phenylpyridine-2-carboximidamide

C19H14Cl2N4 — CID 4264071

IUPACN-[(2,4-dichlorophenyl)methylideneamino]-N'-phenylpyridine-2-carboximidamide
SMILESClc1ccc(C=NN/C(=N/c2ccccc2)c2ccccn2)c(Cl)c1
InChIInChI=1S/C19H14Cl2N4/c20-15-10-9-14(17(21)12-15)13-23-25-19(18-8-4-5-11-22-18)24-16-6-2-1-3-7-16/h1-13H,(H,24,25)
InChIKeyHMNFZOLNAVJCNT-UHFFFAOYSA-N
MW369.26 g/mol
LogP5.09
Rot. Bonds4

About N-[(2,4-dichlorophenyl)methylideneamino]-N'-phenylpyridine-2-carboximidamide

N-[(2,4-dichlorophenyl)methylideneamino]-N'-phenylpyridine-2-carboximidamide (PubChem CID 4264071) has the molecular formula C19H14Cl2N4 and a molecular weight of 369.26 g/mol. Its IUPAC name is N-[(2,4-dichlorophenyl)methylideneamino]-N'-phenylpyridine-2-carboximidamide.

Molecular Properties

Compound NameN-[(2,4-dichlorophenyl)methylideneamino]-N'-phenylpyridine-2-carboximidamide
PubChem CID4264071
Molecular FormulaC19H14Cl2N4
Molecular Weight369.26 g/mol
Exact Mass368.06
IUPAC NameN-[(2,4-dichlorophenyl)methylideneamino]-N'-phenylpyridine-2-carboximidamide
SMILESClc1ccc(C=NN/C(=N/c2ccccc2)c2ccccn2)c(Cl)c1
InChIInChI=1S/C19H14Cl2N4/c20-15-10-9-14(17(21)12-15)13-23-25-19(18-8-4-5-11-22-18)24-16-6-2-1-3-7-16/h1-13H,(H,24,25)
InChIKeyHMNFZOLNAVJCNT-UHFFFAOYSA-N
XLogP5.09
TPSA49.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500369.26
LogP ≤ 55.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[(E)-(2,4-dichlorophenyl)methylideneamino]pyridine-2-carboxamide
CID 139068920
N-[(2,4-dichlorophenyl)methylideneamino]-N'-phenylpyridin-1-ium-2-carboximidamide
CID 135478497
N-[(5-chloro-2-hydroxy-3-nitrophenyl)methylideneamino]-N'-phenylpyridine-2-carboximidamide
CID 3412202
N-[(E)-(3,5-ditert-butyl-4-hydroxyphenyl)methylideneamino]-N'-phenylpyridine-2-carboximidamide
CID 135722741
N-[(Z)-(2-methoxy-5-nitrophenyl)methylideneamino]-N'-phenylpyridine-2-carboximidamide
CID 6032239
[(2,4-dichlorophenyl)methylideneamino]carbamic acid
CID 70469242
N-[(Z)-(2,4-dichlorophenyl)methylideneamino]acetamide
CID 6162520
N-[(E)-[5-[(2,4-dichlorophenyl)diazenyl]-2-hydroxyphenyl]methylideneamino]pyridine-2-carboxamide
CID 155290954
N-[(E)-(4-hydroxy-3-nitrophenyl)methylideneamino]-N'-phenylpyridine-2-carboximidamide
CID 135683256
N-[(5-bromo-2-hydroxyphenyl)methylideneamino]-N'-(4-ethoxyphenyl)pyridine-2-carboximidamide
CID 5229220
2-chloro-N-[(E)-(2,4-dichlorophenyl)methylideneamino]benzamide
CID 5332948
N-[(E)-(5-bromo-2-hydroxyphenyl)methylideneamino]-N'-pyridin-2-ylpyridine-2-carboximidamide
CID 135411868

Frequently Asked Questions

What is the IUPAC name of N-[(2,4-dichlorophenyl)methylideneamino]-N'-phenylpyridine-2-carboximidamide?
The IUPAC name of N-[(2,4-dichlorophenyl)methylideneamino]-N'-phenylpyridine-2-carboximidamide (CID 4264071) is N-[(2,4-dichlorophenyl)methylideneamino]-N'-phenylpyridine-2-carboximidamide.
What is the SMILES notation for N-[(2,4-dichlorophenyl)methylideneamino]-N'-phenylpyridine-2-carboximidamide?
The canonical SMILES for N-[(2,4-dichlorophenyl)methylideneamino]-N'-phenylpyridine-2-carboximidamide is Clc1ccc(C=NN/C(=N/c2ccccc2)c2ccccn2)c(Cl)c1.
What is the InChIKey of N-[(2,4-dichlorophenyl)methylideneamino]-N'-phenylpyridine-2-carboximidamide?
The InChIKey is HMNFZOLNAVJCNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14Cl2N4/c20-15-10-9-14(17(21)12-15)13-23-25-19(18-8-4-5-11-22-18)24-16-6-2-1-3-7-16/h1-13H,(H,24,25).
What are the key properties of N-[(2,4-dichlorophenyl)methylideneamino]-N'-phenylpyridine-2-carboximidamide?
N-[(2,4-dichlorophenyl)methylideneamino]-N'-phenylpyridine-2-carboximidamide has a molecular weight of 369.26 g/mol, XLogP of 5.09, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,4-dichlorophenyl)methylideneamino]-N'-phenylpyridine-2-carboximidamide is sourced from PubChem (CID 4264071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).