1-(5-fluoro-3-pyridinyl)-N-methyl-1-quinolin-5-ylmethanamine

C16H14FN3 — CID 105102666

IUPAC1-(5-fluoro-3-pyridinyl)-N-methyl-1-quinolin-5-ylmethanamine
SMILESCNC(c1cncc(F)c1)c1cccc2ncccc12
InChIInChI=1S/C16H14FN3/c1-18-16(11-8-12(17)10-19-9-11)14-4-2-6-15-13(14)5-3-7-20-15/h2-10,16,18H,1H3
InChIKeyIOSCPQITRXPLBQ-UHFFFAOYSA-N
MW267.31 g/mol
LogP3.08
Rot. Bonds3

About 1-(5-fluoro-3-pyridinyl)-N-methyl-1-quinolin-5-ylmethanamine

1-(5-fluoro-3-pyridinyl)-N-methyl-1-quinolin-5-ylmethanamine (PubChem CID 105102666) has the molecular formula C16H14FN3 and a molecular weight of 267.31 g/mol. Its IUPAC name is 1-(5-fluoro-3-pyridinyl)-N-methyl-1-quinolin-5-ylmethanamine.

Molecular Properties

Compound Name1-(5-fluoro-3-pyridinyl)-N-methyl-1-quinolin-5-ylmethanamine
PubChem CID105102666
Molecular FormulaC16H14FN3
Molecular Weight267.31 g/mol
Exact Mass267.12
IUPAC Name1-(5-fluoro-3-pyridinyl)-N-methyl-1-quinolin-5-ylmethanamine
SMILESCNC(c1cncc(F)c1)c1cccc2ncccc12
InChIInChI=1S/C16H14FN3/c1-18-16(11-8-12(17)10-19-9-11)14-4-2-6-15-13(14)5-3-7-20-15/h2-10,16,18H,1H3
InChIKeyIOSCPQITRXPLBQ-UHFFFAOYSA-N
XLogP3.08
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.31
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(5-fluoro-3-pyridinyl)-N-methyl-1-quinoxalin-5-ylmethanamine
CID 105102445
1-(4-fluorophenyl)-N-methyl-1-quinolin-5-ylmethanamine
CID 78917800
(5-fluoro-3-pyridinyl)-quinolin-5-ylmethanamine
CID 105102211
1-(3,5-dimethylphenyl)-N-methyl-1-quinolin-5-ylmethanamine
CID 105020075
N-methyl-1-(3-methylphenyl)-1-quinolin-5-ylmethanamine
CID 81220394
N-methyl-1-(5-methylthiophen-3-yl)-1-quinolin-5-ylmethanamine
CID 105155662
1-(5-fluoro-3-pyridinyl)-N-methyl-1-quinolin-3-ylmethanamine
CID 105097865
(3,5-difluorophenyl)-quinolin-5-ylmethanamine
CID 81231952
1-(2-iodophenyl)-N-methyl-1-quinolin-5-ylmethanamine
CID 105020092
1-(4-fluorophenyl)-1-(5-fluoro-3-pyridinyl)-N-methylmethanamine
CID 54967877
1-(5-fluoro-2-pyridinyl)-1-(5-fluoro-3-pyridinyl)-N-methylmethanamine
CID 79712254
N-methyl-1-(2-methyl-3-pyridinyl)-1-(5-methyl-3-pyridinyl)methanamine
CID 105173794

Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-3-pyridinyl)-N-methyl-1-quinolin-5-ylmethanamine?
The IUPAC name of 1-(5-fluoro-3-pyridinyl)-N-methyl-1-quinolin-5-ylmethanamine (CID 105102666) is 1-(5-fluoro-3-pyridinyl)-N-methyl-1-quinolin-5-ylmethanamine.
What is the SMILES notation for 1-(5-fluoro-3-pyridinyl)-N-methyl-1-quinolin-5-ylmethanamine?
The canonical SMILES for 1-(5-fluoro-3-pyridinyl)-N-methyl-1-quinolin-5-ylmethanamine is CNC(c1cncc(F)c1)c1cccc2ncccc12.
What is the InChIKey of 1-(5-fluoro-3-pyridinyl)-N-methyl-1-quinolin-5-ylmethanamine?
The InChIKey is IOSCPQITRXPLBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14FN3/c1-18-16(11-8-12(17)10-19-9-11)14-4-2-6-15-13(14)5-3-7-20-15/h2-10,16,18H,1H3.
What are the key properties of 1-(5-fluoro-3-pyridinyl)-N-methyl-1-quinolin-5-ylmethanamine?
1-(5-fluoro-3-pyridinyl)-N-methyl-1-quinolin-5-ylmethanamine has a molecular weight of 267.31 g/mol, XLogP of 3.08, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-fluoro-3-pyridinyl)-N-methyl-1-quinolin-5-ylmethanamine is sourced from PubChem (CID 105102666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).