5-(4-chloro-6-fluoro-7-methoxyquinolin-2-yl)pyridin-2-amine

C15H11ClFN3O — CID 177173158

IUPAC5-(4-chloro-6-fluoro-7-methoxyquinolin-2-yl)pyridin-2-amine
SMILESCOc1cc2nc(-c3ccc(N)nc3)cc(Cl)c2cc1F
InChIInChI=1S/C15H11ClFN3O/c1-21-14-6-13-9(4-11(14)17)10(16)5-12(20-13)8-2-3-15(18)19-7-8/h2-7H,1H3,(H2,18,19)
InChIKeyWGUJYZGQWKLPCA-UHFFFAOYSA-N
MW303.72 g/mol
LogP3.68
Rot. Bonds2

About 5-(4-chloro-6-fluoro-7-methoxyquinolin-2-yl)pyridin-2-amine

5-(4-chloro-6-fluoro-7-methoxyquinolin-2-yl)pyridin-2-amine (PubChem CID 177173158) has the molecular formula C15H11ClFN3O and a molecular weight of 303.72 g/mol. Its IUPAC name is 5-(4-chloro-6-fluoro-7-methoxyquinolin-2-yl)pyridin-2-amine.

Molecular Properties

Compound Name5-(4-chloro-6-fluoro-7-methoxyquinolin-2-yl)pyridin-2-amine
PubChem CID177173158
Molecular FormulaC15H11ClFN3O
Molecular Weight303.72 g/mol
Exact Mass303.06
IUPAC Name5-(4-chloro-6-fluoro-7-methoxyquinolin-2-yl)pyridin-2-amine
SMILESCOc1cc2nc(-c3ccc(N)nc3)cc(Cl)c2cc1F
InChIInChI=1S/C15H11ClFN3O/c1-21-14-6-13-9(4-11(14)17)10(16)5-12(20-13)8-2-3-15(18)19-7-8/h2-7H,1H3,(H2,18,19)
InChIKeyWGUJYZGQWKLPCA-UHFFFAOYSA-N
XLogP3.68
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.72
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[6-(azetidin-1-yl)-3-pyridinyl]-4-chloro-6-fluoro-7-methoxyquinoline
CID 177172502
4-chloro-6-fluoro-7-methoxy-2-(6-pyrrolidin-1-yl-3-pyridinyl)quinoline
CID 177174040
2-(azetidin-1-yl)-5-(4-chloro-6-fluoro-7-methoxyquinolin-2-yl)-1,3-thiazole
CID 177172657
4-chloro-6,7-dimethoxyquinolin-2-amine
CID 141028770
1,7-difluoro-6-methoxy-3-(4-propan-2-ylphenyl)isoquinoline
CID 174788399
5-(3-fluoro-4-methoxyphenyl)pyrimidin-2-amine
CID 57445392
4-chloro-6-fluoro-7-methoxy-2-[2-(4-methylsulfanylphenoxy)ethyl]quinoline
CID 167284418
7-fluoro-6-methoxyisoquinolin-1-amine
CID 82276421
4-(4-chlorophenyl)-6,7-dimethoxyquinazolin-2-amine
CID 22626608
7-chloro-2-(3-fluoro-4-methoxyphenyl)quinazolin-4-amine
CID 64983945
5-(6,7-dimethoxycinnolin-4-yl)pyridin-2-amine
CID 57395734
4-chloro-2-(3-chloro-4-methoxyphenyl)quinoline
CID 18432969

Frequently Asked Questions

What is the IUPAC name of 5-(4-chloro-6-fluoro-7-methoxyquinolin-2-yl)pyridin-2-amine?
The IUPAC name of 5-(4-chloro-6-fluoro-7-methoxyquinolin-2-yl)pyridin-2-amine (CID 177173158) is 5-(4-chloro-6-fluoro-7-methoxyquinolin-2-yl)pyridin-2-amine.
What is the SMILES notation for 5-(4-chloro-6-fluoro-7-methoxyquinolin-2-yl)pyridin-2-amine?
The canonical SMILES for 5-(4-chloro-6-fluoro-7-methoxyquinolin-2-yl)pyridin-2-amine is COc1cc2nc(-c3ccc(N)nc3)cc(Cl)c2cc1F.
What is the InChIKey of 5-(4-chloro-6-fluoro-7-methoxyquinolin-2-yl)pyridin-2-amine?
The InChIKey is WGUJYZGQWKLPCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClFN3O/c1-21-14-6-13-9(4-11(14)17)10(16)5-12(20-13)8-2-3-15(18)19-7-8/h2-7H,1H3,(H2,18,19).
What are the key properties of 5-(4-chloro-6-fluoro-7-methoxyquinolin-2-yl)pyridin-2-amine?
5-(4-chloro-6-fluoro-7-methoxyquinolin-2-yl)pyridin-2-amine has a molecular weight of 303.72 g/mol, XLogP of 3.68, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-chloro-6-fluoro-7-methoxyquinolin-2-yl)pyridin-2-amine is sourced from PubChem (CID 177173158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).