5-bromo-6-chloro-N-[(4-chlorophenyl)methyl]pyridin-2-amine;4-chlorobenzaldehyde;2-chloro-6-[2-(4-chlorophenyl)ethyl]pyridine-3-carbaldehyde;2-chloro-6-[(4-chlorophenyl)methylamino]pyridine-3-carbaldehyde;6-chloro-N-[(4-chlorophenyl)methyl]pyridin-2-amine;6-chloropyridin-2-amine

C63H50BrCl10N9O3 — CID 162244163

IUPAC5-bromo-6-chloro-N-[(4-chlorophenyl)methyl]pyridin-2-amine;4-chlorobenzaldehyde;2-chloro-6-[2-(4-chlorophenyl)ethyl]pyridine-3-carbaldehyde;2-chloro-6-[(4-chlorophenyl)methylamino]pyridine-3-carbaldehyde;6-chloro-N-[(4-chlorophenyl)methyl]pyridin-2-amine;6-chloropyridin-2-amine
SMILESClc1ccc(CNc2ccc(Br)c(Cl)n2)cc1.Clc1ccc(CNc2cccc(Cl)n2)cc1.Nc1cccc(Cl)n1.O=Cc1ccc(CCc2ccc(Cl)cc2)nc1Cl.O=Cc1ccc(Cl)cc1.O=Cc1ccc(NCc2ccc(Cl)cc2)nc1Cl
InChIInChI=1S/C14H11Cl2NO.C13H10Cl2N2O.C12H9BrCl2N2.C12H10Cl2N2.C7H5ClO.C5H5ClN2/c15-12-5-1-10(2-6-12)3-7-13-8-4-11(9-18)14(16)17-13;14-11-4-1-9(2-5-11)7-16-12-6-3-10(8-18)13(15)17-12;13-10-5-6-11(17-12(10)15)16-7-8-1-3-9(14)4-2-8;13-10-6-4-9(5-7-10)8-15-12-3-1-2-11(14)16-12;8-7-3-1-6(5-9)2-4-7;6-4-2-1-3-5(7)8-4/h1-2,4-6,8-9H,3,7H2;1-6,8H,7H2,(H,16,17);1-6H,7H2,(H,16,17);1-7H,8H2,(H,15,16);1-5H;1-3H,(H2,7,8)
InChIKeyZXCJWVVAJOWKAE-UHFFFAOYSA-N
MW1415.59 g/mol
LogP20.03
Rot. Bonds15

About 5-bromo-6-chloro-N-[(4-chlorophenyl)methyl]pyridin-2-amine;4-chlorobenzaldehyde;2-chloro-6-[2-(4-chlorophenyl)ethyl]pyridine-3-carbaldehyde;2-chloro-6-[(4-chlorophenyl)methylamino]pyridine-3-carbaldehyde;6-chloro-N-[(4-chlorophenyl)methyl]pyridin-2-amine;6-chloropyridin-2-amine

5-bromo-6-chloro-N-[(4-chlorophenyl)methyl]pyridin-2-amine;4-chlorobenzaldehyde;2-chloro-6-[2-(4-chlorophenyl)ethyl]pyridine-3-carbaldehyde;2-chloro-6-[(4-chlorophenyl)methylamino]pyridine-3-carbaldehyde;6-chloro-N-[(4-chlorophenyl)methyl]pyridin-2-amine;6-chloropyridin-2-amine (PubChem CID 162244163) has the molecular formula C63H50BrCl10N9O3 and a molecular weight of 1415.59 g/mol. Its IUPAC name is 5-bromo-6-chloro-N-[(4-chlorophenyl)methyl]pyridin-2-amine;4-chlorobenzaldehyde;2-chloro-6-[2-(4-chlorophenyl)ethyl]pyridine-3-carbaldehyde;2-chloro-6-[(4-chlorophenyl)methylamino]pyridine-3-carbaldehyde;6-chloro-N-[(4-chlorophenyl)methyl]pyridin-2-amine;6-chloropyridin-2-amine.

Molecular Properties

Compound Name5-bromo-6-chloro-N-[(4-chlorophenyl)methyl]pyridin-2-amine;4-chlorobenzaldehyde;2-chloro-6-[2-(4-chlorophenyl)ethyl]pyridine-3-carbaldehyde;2-chloro-6-[(4-chlorophenyl)methylamino]pyridine-3-carbaldehyde;6-chloro-N-[(4-chlorophenyl)methyl]pyridin-2-amine;6-chloropyridin-2-amine
PubChem CID162244163
Molecular FormulaC63H50BrCl10N9O3
Molecular Weight1415.59 g/mol
Exact Mass1409.01
IUPAC Name5-bromo-6-chloro-N-[(4-chlorophenyl)methyl]pyridin-2-amine;4-chlorobenzaldehyde;2-chloro-6-[2-(4-chlorophenyl)ethyl]pyridine-3-carbaldehyde;2-chloro-6-[(4-chlorophenyl)methylamino]pyridine-3-carbaldehyde;6-chloro-N-[(4-chlorophenyl)methyl]pyridin-2-amine;6-chloropyridin-2-amine
SMILESClc1ccc(CNc2ccc(Br)c(Cl)n2)cc1.Clc1ccc(CNc2cccc(Cl)n2)cc1.Nc1cccc(Cl)n1.O=Cc1ccc(CCc2ccc(Cl)cc2)nc1Cl.O=Cc1ccc(Cl)cc1.O=Cc1ccc(NCc2ccc(Cl)cc2)nc1Cl
InChIInChI=1S/C14H11Cl2NO.C13H10Cl2N2O.C12H9BrCl2N2.C12H10Cl2N2.C7H5ClO.C5H5ClN2/c15-12-5-1-10(2-6-12)3-7-13-8-4-11(9-18)14(16)17-13;14-11-4-1-9(2-5-11)7-16-12-6-3-10(8-18)13(15)17-12;13-10-5-6-11(17-12(10)15)16-7-8-1-3-9(14)4-2-8;13-10-6-4-9(5-7-10)8-15-12-3-1-2-11(14)16-12;8-7-3-1-6(5-9)2-4-7;6-4-2-1-3-5(7)8-4/h1-2,4-6,8-9H,3,7H2;1-6,8H,7H2,(H,16,17);1-6H,7H2,(H,16,17);1-7H,8H2,(H,15,16);1-5H;1-3H,(H2,7,8)
InChIKeyZXCJWVVAJOWKAE-UHFFFAOYSA-N
XLogP20.03
TPSA177.77 Ų
H-Bond Donors4
H-Bond Acceptors12
Rotatable Bonds15
Heavy Atoms86
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001415.59
LogP ≤ 520.03
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}

Analyze 5-bromo-6-chloro-N-[(4-chlorophenyl)methyl]pyridin-2-amine;4-chlorobenzaldehyde;2-chloro-6-[2-(4-chlorophenyl)ethyl]pyridine-3-carbaldehyde;2-chloro-6-[(4-chlorophenyl)methylamino]pyridine-3-carbaldehyde;6-chloro-N-[(4-chlorophenyl)methyl]pyridin-2-amine;6-chloropyridin-2-amine with MolForge

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Related Compounds

6-(2-chloro-6-methyl-4-pyridinyl)-2-ethenyl-7-phenyl-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-5-ethynyl-2-methyl-7-phenyl-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-5-methyl-7-phenyl-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-phenyl-3-prop-2-enyl-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-phenyl-5-prop-1-en-2-yl-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-7-phenyl-3-prop-2-ynyl-1H-1,8-naphthyridin-4-one
CID 157255042
5-bromo-6-chloro-N-[(4-chlorophenyl)methyl]pyridin-2-amine;4-chlorobenzaldehyde;2-chloro-6-[2-(4-chlorophenyl)ethyl]pyridine-3-carbaldehyde;2-chloro-6-[(4-chlorophenyl)methylamino]pyridine-3-carbaldehyde;6-chloro-N-[(4-chlorophenyl)methyl]pyridin-2-amine;6-chloropyridin-2-amine;1H-pyrrolo[2,3-b]pyridine
CID 158273068
2-bromo-6-(2-chloro-6-methyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;3-bromo-6-(2-chloro-6-methyl-4-pyridinyl)-7-phenyl-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-2-ethynyl-7-phenyl-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-2-fluoro-7-phenyl-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-3-fluoro-7-phenyl-1H-1,8-naphthyridin-4-one;6-(2-chloro-6-methyl-4-pyridinyl)-5-fluoro-7-phenyl-1H-1,8-naphthyridin-4-one
CID 158661486
5-bromo-N-[(4-chlorophenyl)methyl]pyridin-2-amine;5-bromopyridin-2-amine;4-chlorobenzaldehyde;6-[2-(4-chlorophenyl)ethyl]pyridine-3-carbaldehyde;6-[(4-chlorophenyl)methylamino]pyridine-3-carbaldehyde
CID 159190503
5-bromo-N-[(4-chlorophenyl)methyl]pyridin-2-amine;5-bromopyridin-2-amine;tert-butyl N-[(4-chlorophenyl)methyl]-N-(5-formyl-2-pyridinyl)carbamate;4-chlorobenzaldehyde;6-[(4-chlorophenyl)methylamino]pyridine-3-carbaldehyde
CID 159520074
(2-Amino-5-bromo-3-pyridinyl)-(3-chloro-6-piperidin-1-yl-2-pyridinyl)methanone;(2-amino-5-ethenyl-3-pyridinyl)-(3-chloro-6-piperazin-1-yl-2-pyridinyl)methanone
CID 159751290
5-bromo-6-chloro-N-[(4-chlorophenyl)methyl]pyridin-2-amine;4-chlorobenzaldehyde;2-chloro-6-[(4-chlorophenyl)methylamino]pyridine-3-carbaldehyde;6-chloro-N-[(4-chlorophenyl)methyl]pyridin-2-amine;6-chloropyridin-2-amine
CID 159944810

Frequently Asked Questions

What is the IUPAC name of 5-bromo-6-chloro-N-[(4-chlorophenyl)methyl]pyridin-2-amine;4-chlorobenzaldehyde;2-chloro-6-[2-(4-chlorophenyl)ethyl]pyridine-3-carbaldehyde;2-chloro-6-[(4-chlorophenyl)methylamino]pyridine-3-carbaldehyde;6-chloro-N-[(4-chlorophenyl)methyl]pyridin-2-amine;6-chloropyridin-2-amine?
The IUPAC name of 5-bromo-6-chloro-N-[(4-chlorophenyl)methyl]pyridin-2-amine;4-chlorobenzaldehyde;2-chloro-6-[2-(4-chlorophenyl)ethyl]pyridine-3-carbaldehyde;2-chloro-6-[(4-chlorophenyl)methylamino]pyridine-3-carbaldehyde;6-chloro-N-[(4-chlorophenyl)methyl]pyridin-2-amine;6-chloropyridin-2-amine (CID 162244163) is 5-bromo-6-chloro-N-[(4-chlorophenyl)methyl]pyridin-2-amine;4-chlorobenzaldehyde;2-chloro-6-[2-(4-chlorophenyl)ethyl]pyridine-3-carbaldehyde;2-chloro-6-[(4-chlorophenyl)methylamino]pyridine-3-carbaldehyde;6-chloro-N-[(4-chlorophenyl)methyl]pyridin-2-amine;6-chloropyridin-2-amine.
What is the SMILES notation for 5-bromo-6-chloro-N-[(4-chlorophenyl)methyl]pyridin-2-amine;4-chlorobenzaldehyde;2-chloro-6-[2-(4-chlorophenyl)ethyl]pyridine-3-carbaldehyde;2-chloro-6-[(4-chlorophenyl)methylamino]pyridine-3-carbaldehyde;6-chloro-N-[(4-chlorophenyl)methyl]pyridin-2-amine;6-chloropyridin-2-amine?
The canonical SMILES for 5-bromo-6-chloro-N-[(4-chlorophenyl)methyl]pyridin-2-amine;4-chlorobenzaldehyde;2-chloro-6-[2-(4-chlorophenyl)ethyl]pyridine-3-carbaldehyde;2-chloro-6-[(4-chlorophenyl)methylamino]pyridine-3-carbaldehyde;6-chloro-N-[(4-chlorophenyl)methyl]pyridin-2-amine;6-chloropyridin-2-amine is Clc1ccc(CNc2ccc(Br)c(Cl)n2)cc1.Clc1ccc(CNc2cccc(Cl)n2)cc1.Nc1cccc(Cl)n1.O=Cc1ccc(CCc2ccc(Cl)cc2)nc1Cl.O=Cc1ccc(Cl)cc1.O=Cc1ccc(NCc2ccc(Cl)cc2)nc1Cl.
What is the InChIKey of 5-bromo-6-chloro-N-[(4-chlorophenyl)methyl]pyridin-2-amine;4-chlorobenzaldehyde;2-chloro-6-[2-(4-chlorophenyl)ethyl]pyridine-3-carbaldehyde;2-chloro-6-[(4-chlorophenyl)methylamino]pyridine-3-carbaldehyde;6-chloro-N-[(4-chlorophenyl)methyl]pyridin-2-amine;6-chloropyridin-2-amine?
The InChIKey is ZXCJWVVAJOWKAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Cl2NO.C13H10Cl2N2O.C12H9BrCl2N2.C12H10Cl2N2.C7H5ClO.C5H5ClN2/c15-12-5-1-10(2-6-12)3-7-13-8-4-11(9-18)14(16)17-13;14-11-4-1-9(2-5-11)7-16-12-6-3-10(8-18)13(15)17-12;13-10-5-6-11(17-12(10)15)16-7-8-1-3-9(14)4-2-8;13-10-6-4-9(5-7-10)8-15-12-3-1-2-11(14)16-12;8-7-3-1-6(5-9)2-4-7;6-4-2-1-3-5(7)8-4/h1-2,4-6,8-9H,3,7H2;1-6,8H,7H2,(H,16,17);1-6H,7H2,(H,16,17);1-7H,8H2,(H,15,16);1-5H;1-3H,(H2,7,8).
What are the key properties of 5-bromo-6-chloro-N-[(4-chlorophenyl)methyl]pyridin-2-amine;4-chlorobenzaldehyde;2-chloro-6-[2-(4-chlorophenyl)ethyl]pyridine-3-carbaldehyde;2-chloro-6-[(4-chlorophenyl)methylamino]pyridine-3-carbaldehyde;6-chloro-N-[(4-chlorophenyl)methyl]pyridin-2-amine;6-chloropyridin-2-amine?
5-bromo-6-chloro-N-[(4-chlorophenyl)methyl]pyridin-2-amine;4-chlorobenzaldehyde;2-chloro-6-[2-(4-chlorophenyl)ethyl]pyridine-3-carbaldehyde;2-chloro-6-[(4-chlorophenyl)methylamino]pyridine-3-carbaldehyde;6-chloro-N-[(4-chlorophenyl)methyl]pyridin-2-amine;6-chloropyridin-2-amine has a molecular weight of 1415.59 g/mol, XLogP of 20.03, 15 rotatable bonds, 4 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-6-chloro-N-[(4-chlorophenyl)methyl]pyridin-2-amine;4-chlorobenzaldehyde;2-chloro-6-[2-(4-chlorophenyl)ethyl]pyridine-3-carbaldehyde;2-chloro-6-[(4-chlorophenyl)methylamino]pyridine-3-carbaldehyde;6-chloro-N-[(4-chlorophenyl)methyl]pyridin-2-amine;6-chloropyridin-2-amine is sourced from PubChem (CID 162244163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).