5-(5,7-difluoroquinolin-8-yl)-6-ethylpyridin-2-amine;hydrochloride

C16H14ClF2N3 — CID 166059169

IUPAC5-(5,7-difluoroquinolin-8-yl)-6-ethylpyridin-2-amine;hydrochloride
SMILESCCc1nc(N)ccc1-c1c(F)cc(F)c2cccnc12.Cl
InChIInChI=1S/C16H13F2N3.ClH/c1-2-13-10(5-6-14(19)21-13)15-12(18)8-11(17)9-4-3-7-20-16(9)15;/h3-8H,2H2,1H3,(H2,19,21);1H
InChIKeyBWMUSIRQWXGAFI-UHFFFAOYSA-N
MW321.76 g/mol
LogP4.14
Rot. Bonds2

About 5-(5,7-difluoroquinolin-8-yl)-6-ethylpyridin-2-amine;hydrochloride

5-(5,7-difluoroquinolin-8-yl)-6-ethylpyridin-2-amine;hydrochloride (PubChem CID 166059169) has the molecular formula C16H14ClF2N3 and a molecular weight of 321.76 g/mol. Its IUPAC name is 5-(5,7-difluoroquinolin-8-yl)-6-ethylpyridin-2-amine;hydrochloride.

Molecular Properties

Compound Name5-(5,7-difluoroquinolin-8-yl)-6-ethylpyridin-2-amine;hydrochloride
PubChem CID166059169
Molecular FormulaC16H14ClF2N3
Molecular Weight321.76 g/mol
Exact Mass321.08
IUPAC Name5-(5,7-difluoroquinolin-8-yl)-6-ethylpyridin-2-amine;hydrochloride
SMILESCCc1nc(N)ccc1-c1c(F)cc(F)c2cccnc12.Cl
InChIInChI=1S/C16H13F2N3.ClH/c1-2-13-10(5-6-14(19)21-13)15-12(18)8-11(17)9-4-3-7-20-16(9)15;/h3-8H,2H2,1H3,(H2,19,21);1H
InChIKeyBWMUSIRQWXGAFI-UHFFFAOYSA-N
XLogP4.14
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.76
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(3,7-difluoroquinolin-8-yl)-6-ethylpyridin-2-amine;hydrochloride
CID 166059230
5-(3,7-difluoroquinolin-8-yl)-6-ethylpyridin-2-amine
CID 155778631
6-ethyl-5-(4-methylquinolin-8-yl)pyridin-2-amine;hydrochloride
CID 166059256
8-ethyl-1,7-naphthyridin-6-amine
CID 53237023
6-ethyl-5-fluoropyridin-2-amine
CID 153053935
6-ethyl-5-(2-methyl-1-benzothiophen-3-yl)pyridin-2-amine
CID 155778424
6-ethyl-5-(2-pyridin-2-ylquinolin-8-yl)pyridin-2-amine;hydrochloride
CID 166059179
8-(6-ethyl-2-pyrrolidin-1-ylpyrimidin-4-yl)-5-fluoroquinoline
CID 74249674
5-(4-chlorophenyl)-6-ethylpyridin-2-amine
CID 58709674
5-methyl-1,10-phenanthrolin-2-amine
CID 121279009
6-ethyl-5-(2-pyridin-3-ylquinolin-8-yl)pyridin-2-amine
CID 155778421
6-ethyl-5-imidazo[1,2-a]pyridin-5-ylpyridin-2-amine;hydrochloride
CID 166059178

Frequently Asked Questions

What is the IUPAC name of 5-(5,7-difluoroquinolin-8-yl)-6-ethylpyridin-2-amine;hydrochloride?
The IUPAC name of 5-(5,7-difluoroquinolin-8-yl)-6-ethylpyridin-2-amine;hydrochloride (CID 166059169) is 5-(5,7-difluoroquinolin-8-yl)-6-ethylpyridin-2-amine;hydrochloride.
What is the SMILES notation for 5-(5,7-difluoroquinolin-8-yl)-6-ethylpyridin-2-amine;hydrochloride?
The canonical SMILES for 5-(5,7-difluoroquinolin-8-yl)-6-ethylpyridin-2-amine;hydrochloride is CCc1nc(N)ccc1-c1c(F)cc(F)c2cccnc12.Cl.
What is the InChIKey of 5-(5,7-difluoroquinolin-8-yl)-6-ethylpyridin-2-amine;hydrochloride?
The InChIKey is BWMUSIRQWXGAFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13F2N3.ClH/c1-2-13-10(5-6-14(19)21-13)15-12(18)8-11(17)9-4-3-7-20-16(9)15;/h3-8H,2H2,1H3,(H2,19,21);1H.
What are the key properties of 5-(5,7-difluoroquinolin-8-yl)-6-ethylpyridin-2-amine;hydrochloride?
5-(5,7-difluoroquinolin-8-yl)-6-ethylpyridin-2-amine;hydrochloride has a molecular weight of 321.76 g/mol, XLogP of 4.14, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5,7-difluoroquinolin-8-yl)-6-ethylpyridin-2-amine;hydrochloride is sourced from PubChem (CID 166059169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).