1-(5-fluoro-3-pyridinyl)-N-methyl-1-quinolin-2-ylmethanamine

C16H14FN3 — CID 63222854

IUPAC1-(5-fluoro-3-pyridinyl)-N-methyl-1-quinolin-2-ylmethanamine
SMILESCNC(c1cncc(F)c1)c1ccc2ccccc2n1
InChIInChI=1S/C16H14FN3/c1-18-16(12-8-13(17)10-19-9-12)15-7-6-11-4-2-3-5-14(11)20-15/h2-10,16,18H,1H3
InChIKeyKHZQWGVALYDMBV-UHFFFAOYSA-N
MW267.31 g/mol
LogP3.08
Rot. Bonds3

About 1-(5-fluoro-3-pyridinyl)-N-methyl-1-quinolin-2-ylmethanamine

1-(5-fluoro-3-pyridinyl)-N-methyl-1-quinolin-2-ylmethanamine (PubChem CID 63222854) 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-2-ylmethanamine.

Molecular Properties

Compound Name1-(5-fluoro-3-pyridinyl)-N-methyl-1-quinolin-2-ylmethanamine
PubChem CID63222854
Molecular FormulaC16H14FN3
Molecular Weight267.31 g/mol
Exact Mass267.12
IUPAC Name1-(5-fluoro-3-pyridinyl)-N-methyl-1-quinolin-2-ylmethanamine
SMILESCNC(c1cncc(F)c1)c1ccc2ccccc2n1
InChIInChI=1S/C16H14FN3/c1-18-16(12-8-13(17)10-19-9-12)15-7-6-11-4-2-3-5-14(11)20-15/h2-10,16,18H,1H3
InChIKeyKHZQWGVALYDMBV-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-quinolin-3-ylmethanamine
CID 105097865
1-(5-fluoro-2-pyridinyl)-1-(5-fluoro-3-pyridinyl)-N-methylmethanamine
CID 79712254
1-(2,5-difluorophenyl)-N-methyl-1-quinolin-2-ylmethanamine
CID 63222517
1-(3,5-difluorophenyl)-N-methyl-1-quinoxalin-2-ylmethanamine
CID 107357086
1-(4-fluorophenyl)-1-(5-fluoro-3-pyridinyl)-N-methylmethanamine
CID 54967877
1-(4-chlorophenyl)-1-(5-fluoro-3-pyridinyl)-N-methylmethanamine
CID 54967967
1-(5-fluoro-3-pyridinyl)-N-methyl-1-quinoxalin-5-ylmethanamine
CID 105102445
1-(5-fluoro-3-pyridinyl)-N-methyl-1-quinolin-5-ylmethanamine
CID 105102666
1-(4-fluorophenyl)-N-methyl-1-quinoxalin-2-ylmethanamine
CID 107356910
1-(3,4-dichlorophenyl)-1-(5-fluoro-3-pyridinyl)-N-methylmethanamine
CID 81492170
1-(4-tert-butylphenyl)-1-(5-fluoro-3-pyridinyl)-N-methylmethanamine
CID 115805098
N-[(4-fluorophenyl)-quinolin-2-ylmethyl]ethanamine
CID 63222518

Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-3-pyridinyl)-N-methyl-1-quinolin-2-ylmethanamine?
The IUPAC name of 1-(5-fluoro-3-pyridinyl)-N-methyl-1-quinolin-2-ylmethanamine (CID 63222854) is 1-(5-fluoro-3-pyridinyl)-N-methyl-1-quinolin-2-ylmethanamine.
What is the SMILES notation for 1-(5-fluoro-3-pyridinyl)-N-methyl-1-quinolin-2-ylmethanamine?
The canonical SMILES for 1-(5-fluoro-3-pyridinyl)-N-methyl-1-quinolin-2-ylmethanamine is CNC(c1cncc(F)c1)c1ccc2ccccc2n1.
What is the InChIKey of 1-(5-fluoro-3-pyridinyl)-N-methyl-1-quinolin-2-ylmethanamine?
The InChIKey is KHZQWGVALYDMBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14FN3/c1-18-16(12-8-13(17)10-19-9-12)15-7-6-11-4-2-3-5-14(11)20-15/h2-10,16,18H,1H3.
What are the key properties of 1-(5-fluoro-3-pyridinyl)-N-methyl-1-quinolin-2-ylmethanamine?
1-(5-fluoro-3-pyridinyl)-N-methyl-1-quinolin-2-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-2-ylmethanamine is sourced from PubChem (CID 63222854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).