5-(3,7-difluoroquinolin-8-yl)-6-ethylpyridin-2-amine;hydrochloride

C16H14ClF2N3 — CID 166059230

IUPAC5-(3,7-difluoroquinolin-8-yl)-6-ethylpyridin-2-amine;hydrochloride
SMILESCCc1nc(N)ccc1-c1c(F)ccc2cc(F)cnc12.Cl
InChIInChI=1S/C16H13F2N3.ClH/c1-2-13-11(4-6-14(19)21-13)15-12(18)5-3-9-7-10(17)8-20-16(9)15;/h3-8H,2H2,1H3,(H2,19,21);1H
InChIKeyNJZTWSJGWWQQTJ-UHFFFAOYSA-N
MW321.76 g/mol
LogP4.14
Rot. Bonds2

About 5-(3,7-difluoroquinolin-8-yl)-6-ethylpyridin-2-amine;hydrochloride

5-(3,7-difluoroquinolin-8-yl)-6-ethylpyridin-2-amine;hydrochloride (PubChem CID 166059230) has the molecular formula C16H14ClF2N3 and a molecular weight of 321.76 g/mol. Its IUPAC name is 5-(3,7-difluoroquinolin-8-yl)-6-ethylpyridin-2-amine;hydrochloride.

Molecular Properties

Compound Name5-(3,7-difluoroquinolin-8-yl)-6-ethylpyridin-2-amine;hydrochloride
PubChem CID166059230
Molecular FormulaC16H14ClF2N3
Molecular Weight321.76 g/mol
Exact Mass321.08
IUPAC Name5-(3,7-difluoroquinolin-8-yl)-6-ethylpyridin-2-amine;hydrochloride
SMILESCCc1nc(N)ccc1-c1c(F)ccc2cc(F)cnc12.Cl
InChIInChI=1S/C16H13F2N3.ClH/c1-2-13-11(4-6-14(19)21-13)15-12(18)5-3-9-7-10(17)8-20-16(9)15;/h3-8H,2H2,1H3,(H2,19,21);1H
InChIKeyNJZTWSJGWWQQTJ-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
CID 155778631
5-(5,7-difluoroquinolin-8-yl)-6-ethylpyridin-2-amine;hydrochloride
CID 166059169
6-ethyl-5-fluoropyridin-2-amine
CID 153053935
5-(4-chlorophenyl)-6-ethylpyridin-2-amine
CID 58709674
6-ethyl-5-(4-methylquinolin-8-yl)pyridin-2-amine;hydrochloride
CID 166059256
3-(6-amino-2-ethyl-3-pyridinyl)-N-ethyl-7-fluoro-N-propan-2-ylquinolin-2-amine
CID 175711134
1-ethyl-7-fluoroisoquinolin-3-amine
CID 146652892
6-ethyl-5-(2-methyl-1-benzothiophen-3-yl)pyridin-2-amine
CID 155778424
5-(8-ethyl-2-fluoroquinazolin-6-yl)-6-methylpyridin-2-amine
CID 138707045
6-ethyl-5-[2-(6-methyl-3-pyridinyl)phenyl]pyridin-2-amine
CID 155778575
3,8-difluoro-5-methyl-1,10-phenanthroline
CID 59318960
2-ethyl-6,8-difluoroquinoline
CID 51361067

Frequently Asked Questions

What is the IUPAC name of 5-(3,7-difluoroquinolin-8-yl)-6-ethylpyridin-2-amine;hydrochloride?
The IUPAC name of 5-(3,7-difluoroquinolin-8-yl)-6-ethylpyridin-2-amine;hydrochloride (CID 166059230) is 5-(3,7-difluoroquinolin-8-yl)-6-ethylpyridin-2-amine;hydrochloride.
What is the SMILES notation for 5-(3,7-difluoroquinolin-8-yl)-6-ethylpyridin-2-amine;hydrochloride?
The canonical SMILES for 5-(3,7-difluoroquinolin-8-yl)-6-ethylpyridin-2-amine;hydrochloride is CCc1nc(N)ccc1-c1c(F)ccc2cc(F)cnc12.Cl.
What is the InChIKey of 5-(3,7-difluoroquinolin-8-yl)-6-ethylpyridin-2-amine;hydrochloride?
The InChIKey is NJZTWSJGWWQQTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13F2N3.ClH/c1-2-13-11(4-6-14(19)21-13)15-12(18)5-3-9-7-10(17)8-20-16(9)15;/h3-8H,2H2,1H3,(H2,19,21);1H.
What are the key properties of 5-(3,7-difluoroquinolin-8-yl)-6-ethylpyridin-2-amine;hydrochloride?
5-(3,7-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-(3,7-difluoroquinolin-8-yl)-6-ethylpyridin-2-amine;hydrochloride is sourced from PubChem (CID 166059230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).