4-(4-chlorophenyl)-N-[(E)-ethylideneamino]-5-(2-fluorophenyl)pyridin-2-amine

C19H15ClFN3 — CID 143379985

IUPAC4-(4-chlorophenyl)-N-[(E)-ethylideneamino]-5-(2-fluorophenyl)pyridin-2-amine
SMILESC/C=N/Nc1cc(-c2ccc(Cl)cc2)c(-c2ccccc2F)cn1
InChIInChI=1S/C19H15ClFN3/c1-2-23-24-19-11-16(13-7-9-14(20)10-8-13)17(12-22-19)15-5-3-4-6-18(15)21/h2-12H,1H3,(H,22,24)/b23-2+
InChIKeyLHJQJYGFDXPCOU-ZTHPEUCGSA-N
MW339.80 g/mol
LogP5.63
Rot. Bonds4

About 4-(4-chlorophenyl)-N-[(E)-ethylideneamino]-5-(2-fluorophenyl)pyridin-2-amine

4-(4-chlorophenyl)-N-[(E)-ethylideneamino]-5-(2-fluorophenyl)pyridin-2-amine (PubChem CID 143379985) has the molecular formula C19H15ClFN3 and a molecular weight of 339.80 g/mol. Its IUPAC name is 4-(4-chlorophenyl)-N-[(E)-ethylideneamino]-5-(2-fluorophenyl)pyridin-2-amine.

Molecular Properties

Compound Name4-(4-chlorophenyl)-N-[(E)-ethylideneamino]-5-(2-fluorophenyl)pyridin-2-amine
PubChem CID143379985
Molecular FormulaC19H15ClFN3
Molecular Weight339.80 g/mol
Exact Mass339.09
IUPAC Name4-(4-chlorophenyl)-N-[(E)-ethylideneamino]-5-(2-fluorophenyl)pyridin-2-amine
SMILESC/C=N/Nc1cc(-c2ccc(Cl)cc2)c(-c2ccccc2F)cn1
InChIInChI=1S/C19H15ClFN3/c1-2-23-24-19-11-16(13-7-9-14(20)10-8-13)17(12-22-19)15-5-3-4-6-18(15)21/h2-12H,1H3,(H,22,24)/b23-2+
InChIKeyLHJQJYGFDXPCOU-ZTHPEUCGSA-N
XLogP5.63
TPSA37.28 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500339.80
LogP ≤ 55.63
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'}

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Related Compounds

N-[[5-(2-chlorophenyl)-4-(4-chlorophenyl)-2-pyridinyl]amino]formamide
CID 143380111
acetylene;6-(2-chlorophenyl)-5-(4-chlorophenyl)-N-[(E)-ethylideneamino]pyridazin-3-amine;ethane;N-methylethanimine;2-methylprop-1-en-1-ol
CID 143380016
1-fluoro-2-[2-(4-methylphenyl)phenyl]benzene
CID 139250939
1,4-bis(2-fluorophenyl)benzene
CID 58121760
6-chloro-N-[(E)-(4-chlorophenyl)methylideneamino]-5-phenylpyridazin-3-amine
CID 139227329
1-fluoro-2-[2-(2-phenylphenyl)phenyl]benzene
CID 141475621
2-fluoro-3-(2-fluorophenyl)-5-methylpyridine
CID 46312592
[4,5-bis(4-chlorophenyl)-2-pyridinyl]methanamine
CID 134228110
3-(4-chlorophenyl)-2-(2-fluorophenyl)quinoline
CID 22399508
[2-chloro-5-(2-fluorophenyl)-3-pyridinyl]methanol
CID 119021722
2-(4-chlorophenyl)-6-(2-fluorophenyl)-4-methylsulfanylpyridine
CID 14551214
4-N,6-N-bis[(E)-(4-chlorophenyl)methylideneamino]pyrimidine-4,6-diamine
CID 86279724

Frequently Asked Questions

What is the IUPAC name of 4-(4-chlorophenyl)-N-[(E)-ethylideneamino]-5-(2-fluorophenyl)pyridin-2-amine?
The IUPAC name of 4-(4-chlorophenyl)-N-[(E)-ethylideneamino]-5-(2-fluorophenyl)pyridin-2-amine (CID 143379985) is 4-(4-chlorophenyl)-N-[(E)-ethylideneamino]-5-(2-fluorophenyl)pyridin-2-amine.
What is the SMILES notation for 4-(4-chlorophenyl)-N-[(E)-ethylideneamino]-5-(2-fluorophenyl)pyridin-2-amine?
The canonical SMILES for 4-(4-chlorophenyl)-N-[(E)-ethylideneamino]-5-(2-fluorophenyl)pyridin-2-amine is C/C=N/Nc1cc(-c2ccc(Cl)cc2)c(-c2ccccc2F)cn1.
What is the InChIKey of 4-(4-chlorophenyl)-N-[(E)-ethylideneamino]-5-(2-fluorophenyl)pyridin-2-amine?
The InChIKey is LHJQJYGFDXPCOU-ZTHPEUCGSA-N. The full InChI is InChI=1S/C19H15ClFN3/c1-2-23-24-19-11-16(13-7-9-14(20)10-8-13)17(12-22-19)15-5-3-4-6-18(15)21/h2-12H,1H3,(H,22,24)/b23-2+.
What are the key properties of 4-(4-chlorophenyl)-N-[(E)-ethylideneamino]-5-(2-fluorophenyl)pyridin-2-amine?
4-(4-chlorophenyl)-N-[(E)-ethylideneamino]-5-(2-fluorophenyl)pyridin-2-amine has a molecular weight of 339.80 g/mol, XLogP of 5.63, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-chlorophenyl)-N-[(E)-ethylideneamino]-5-(2-fluorophenyl)pyridin-2-amine is sourced from PubChem (CID 143379985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).