5,7-dichloro-N-(4-fluorophenyl)-2-pyridin-2-ylquinolin-8-amine

C20H12Cl2FN3 — CID 143696537

IUPAC5,7-dichloro-N-(4-fluorophenyl)-2-pyridin-2-ylquinolin-8-amine
SMILESFc1ccc(Nc2c(Cl)cc(Cl)c3ccc(-c4ccccn4)nc23)cc1
InChIInChI=1S/C20H12Cl2FN3/c21-15-11-16(22)20(25-13-6-4-12(23)5-7-13)19-14(15)8-9-18(26-19)17-3-1-2-10-24-17/h1-11,25H
InChIKeyVTFCBUFOSKNWIL-UHFFFAOYSA-N
MW384.24 g/mol
LogP6.49
Rot. Bonds3

About 5,7-dichloro-N-(4-fluorophenyl)-2-pyridin-2-ylquinolin-8-amine

5,7-dichloro-N-(4-fluorophenyl)-2-pyridin-2-ylquinolin-8-amine (PubChem CID 143696537) has the molecular formula C20H12Cl2FN3 and a molecular weight of 384.24 g/mol. Its IUPAC name is 5,7-dichloro-N-(4-fluorophenyl)-2-pyridin-2-ylquinolin-8-amine.

Molecular Properties

Compound Name5,7-dichloro-N-(4-fluorophenyl)-2-pyridin-2-ylquinolin-8-amine
PubChem CID143696537
Molecular FormulaC20H12Cl2FN3
Molecular Weight384.24 g/mol
Exact Mass383.04
IUPAC Name5,7-dichloro-N-(4-fluorophenyl)-2-pyridin-2-ylquinolin-8-amine
SMILESFc1ccc(Nc2c(Cl)cc(Cl)c3ccc(-c4ccccn4)nc23)cc1
InChIInChI=1S/C20H12Cl2FN3/c21-15-11-16(22)20(25-13-6-4-12(23)5-7-13)19-14(15)8-9-18(26-19)17-3-1-2-10-24-17/h1-11,25H
InChIKeyVTFCBUFOSKNWIL-UHFFFAOYSA-N
XLogP6.49
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.24
LogP ≤ 56.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[bis(pyridin-2-ylmethyl)amino]methyl]-5,7-dichloro-N-(4-methylphenyl)quinolin-8-amine;methanediol
CID 143696587
N-(4-fluorophenyl)-4-pyridin-2-yl-1,3-thiazol-2-amine;hydrobromide
CID 91800824
2-chloro-3-fluoro-6-pyridin-2-ylpyridine
CID 175788383
2-chloro-9-pyridin-2-yl-1,10-phenanthroline
CID 170902643
3,8-dipyridin-2-yl-4,7-phenanthroline
CID 91243626
N-phenylaniline;2-pyridin-2-ylpyridine
CID 175252376
4-chloro-2-pyridin-2-ylquinoline
CID 24903559
5-chloro-7-iodoquinolin-8-ol;5,7-dichloro-2-ethylquinolin-8-ol;5,7-dichloro-2-pyridin-2-ylquinolin-8-ol
CID 159232713
5-pyridin-2-yl-6,9,15,26-tetrazahexacyclo[12.12.0.02,7.08,13.016,25.018,23]hexacosa-1(26),2(7),3,5,8(13),9,11,14,16,18,20,22,24-tridecaene
CID 102037216
CID 177481752
CID 177481752
4,7-dibromo-2,9-dipyridin-2-yl-1,10-phenanthroline
CID 155602097
N-(5-fluoro-2-pyridinyl)-6-pyridin-2-ylpyridin-2-amine
CID 69234797

Frequently Asked Questions

What is the IUPAC name of 5,7-dichloro-N-(4-fluorophenyl)-2-pyridin-2-ylquinolin-8-amine?
The IUPAC name of 5,7-dichloro-N-(4-fluorophenyl)-2-pyridin-2-ylquinolin-8-amine (CID 143696537) is 5,7-dichloro-N-(4-fluorophenyl)-2-pyridin-2-ylquinolin-8-amine.
What is the SMILES notation for 5,7-dichloro-N-(4-fluorophenyl)-2-pyridin-2-ylquinolin-8-amine?
The canonical SMILES for 5,7-dichloro-N-(4-fluorophenyl)-2-pyridin-2-ylquinolin-8-amine is Fc1ccc(Nc2c(Cl)cc(Cl)c3ccc(-c4ccccn4)nc23)cc1.
What is the InChIKey of 5,7-dichloro-N-(4-fluorophenyl)-2-pyridin-2-ylquinolin-8-amine?
The InChIKey is VTFCBUFOSKNWIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H12Cl2FN3/c21-15-11-16(22)20(25-13-6-4-12(23)5-7-13)19-14(15)8-9-18(26-19)17-3-1-2-10-24-17/h1-11,25H.
What are the key properties of 5,7-dichloro-N-(4-fluorophenyl)-2-pyridin-2-ylquinolin-8-amine?
5,7-dichloro-N-(4-fluorophenyl)-2-pyridin-2-ylquinolin-8-amine has a molecular weight of 384.24 g/mol, XLogP of 6.49, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-dichloro-N-(4-fluorophenyl)-2-pyridin-2-ylquinolin-8-amine is sourced from PubChem (CID 143696537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).