4-ethenyl-7-fluoro-3-methyl-2-pyridin-2-ylquinoline

C17H13FN2 — CID 59631216

IUPAC4-ethenyl-7-fluoro-3-methyl-2-pyridin-2-ylquinoline
SMILESC=Cc1c(C)c(-c2ccccn2)nc2cc(F)ccc12
InChIInChI=1S/C17H13FN2/c1-3-13-11(2)17(15-6-4-5-9-19-15)20-16-10-12(18)7-8-14(13)16/h3-10H,1H2,2H3
InChIKeyIRCFCHUQAROOMZ-UHFFFAOYSA-N
MW264.30 g/mol
LogP4.39
Rot. Bonds2

About 4-ethenyl-7-fluoro-3-methyl-2-pyridin-2-ylquinoline

4-ethenyl-7-fluoro-3-methyl-2-pyridin-2-ylquinoline (PubChem CID 59631216) has the molecular formula C17H13FN2 and a molecular weight of 264.30 g/mol. Its IUPAC name is 4-ethenyl-7-fluoro-3-methyl-2-pyridin-2-ylquinoline.

Molecular Properties

Compound Name4-ethenyl-7-fluoro-3-methyl-2-pyridin-2-ylquinoline
PubChem CID59631216
Molecular FormulaC17H13FN2
Molecular Weight264.30 g/mol
Exact Mass264.11
IUPAC Name4-ethenyl-7-fluoro-3-methyl-2-pyridin-2-ylquinoline
SMILESC=Cc1c(C)c(-c2ccccn2)nc2cc(F)ccc12
InChIInChI=1S/C17H13FN2/c1-3-13-11(2)17(15-6-4-5-9-19-15)20-16-10-12(18)7-8-14(13)16/h3-10H,1H2,2H3
InChIKeyIRCFCHUQAROOMZ-UHFFFAOYSA-N
XLogP4.39
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.30
LogP ≤ 54.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(3-bromophenoxy)-7-fluoro-3-methyl-2-pyridin-2-ylquinoline
CID 141294738
4-chloro-7-fluoro-3-methyl-2,6-dipyridin-2-ylquinoline
CID 59631148
4-[3,3-dimethyl-6-(2-methylpyrimidin-4-yl)-2H-pyrrolo[3,2-b]pyridin-1-yl]-7-fluoro-3-methyl-2-pyridin-2-ylquinoline
CID 90858994
4-[3,3-dimethyl-6-(1H-pyrazol-4-yl)-2H-pyrrolo[3,2-b]pyridin-1-yl]-7-fluoro-3-methyl-2-pyridin-2-ylquinoline
CID 50938950
1-(7-fluoro-3-methyl-2-pyridin-2-ylquinolin-4-yl)-3,3-dimethyl-2H-pyrrolo[3,2-b]pyridine-6-carboxamide
CID 50938948
3-(chloromethyl)-5,7-difluoro-2-pyridin-2-ylquinoline
CID 90905440
N-[3-[(dimethylamino)methyl]-5-morpholin-4-ylphenyl]-7-fluoro-3-methyl-2-pyridin-2-ylquinolin-4-amine
CID 59631388
ethane;N-[(1Z)-1-(6-fluoro-2-methyl-3-pyridin-2-ylquinolin-4-yl)buta-1,3-dienyl]ethanimine
CID 145212591
N-[5-(1,1-dihydroxy-1,4-thiazinan-4-yl)-2-morpholin-4-yl-3-pyridinyl]-7-fluoro-3-methyl-2-pyridin-2-ylquinolin-4-amine
CID 68783405
4,6-dichloro-7-methoxy-3-methyl-2-pyridin-2-ylquinoline
CID 59631212
N-cyclopropyl-3-[(7-fluoro-3-methyl-2-pyridin-2-ylquinolin-4-yl)amino]-5-morpholin-4-ylbenzamide
CID 67507904
N-(3-bromophenyl)-5,7-difluoro-3-methyl-2-pyridin-2-ylquinolin-4-amine
CID 59631259

Frequently Asked Questions

What is the IUPAC name of 4-ethenyl-7-fluoro-3-methyl-2-pyridin-2-ylquinoline?
The IUPAC name of 4-ethenyl-7-fluoro-3-methyl-2-pyridin-2-ylquinoline (CID 59631216) is 4-ethenyl-7-fluoro-3-methyl-2-pyridin-2-ylquinoline.
What is the SMILES notation for 4-ethenyl-7-fluoro-3-methyl-2-pyridin-2-ylquinoline?
The canonical SMILES for 4-ethenyl-7-fluoro-3-methyl-2-pyridin-2-ylquinoline is C=Cc1c(C)c(-c2ccccn2)nc2cc(F)ccc12.
What is the InChIKey of 4-ethenyl-7-fluoro-3-methyl-2-pyridin-2-ylquinoline?
The InChIKey is IRCFCHUQAROOMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13FN2/c1-3-13-11(2)17(15-6-4-5-9-19-15)20-16-10-12(18)7-8-14(13)16/h3-10H,1H2,2H3.
What are the key properties of 4-ethenyl-7-fluoro-3-methyl-2-pyridin-2-ylquinoline?
4-ethenyl-7-fluoro-3-methyl-2-pyridin-2-ylquinoline has a molecular weight of 264.30 g/mol, XLogP of 4.39, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenyl-7-fluoro-3-methyl-2-pyridin-2-ylquinoline is sourced from PubChem (CID 59631216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).