[3-fluoro-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-4-pyridinyl]methanamine

C16H18FN3 — CID 105389866

IUPAC[3-fluoro-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-4-pyridinyl]methanamine
SMILESCC1Cc2ccccc2N(c2nccc(CN)c2F)C1
InChIInChI=1S/C16H18FN3/c1-11-8-12-4-2-3-5-14(12)20(10-11)16-15(17)13(9-18)6-7-19-16/h2-7,11H,8-10,18H2,1H3
InChIKeyOAKKOFRQNQRQJA-UHFFFAOYSA-N
MW271.34 g/mol
LogP3.01
Rot. Bonds2

About [3-fluoro-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-4-pyridinyl]methanamine

[3-fluoro-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-4-pyridinyl]methanamine (PubChem CID 105389866) has the molecular formula C16H18FN3 and a molecular weight of 271.34 g/mol. Its IUPAC name is [3-fluoro-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-4-pyridinyl]methanamine.

Molecular Properties

Compound Name[3-fluoro-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-4-pyridinyl]methanamine
PubChem CID105389866
Molecular FormulaC16H18FN3
Molecular Weight271.34 g/mol
Exact Mass271.15
IUPAC Name[3-fluoro-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-4-pyridinyl]methanamine
SMILESCC1Cc2ccccc2N(c2nccc(CN)c2F)C1
InChIInChI=1S/C16H18FN3/c1-11-8-12-4-2-3-5-14(12)20(10-11)16-15(17)13(9-18)6-7-19-16/h2-7,11H,8-10,18H2,1H3
InChIKeyOAKKOFRQNQRQJA-UHFFFAOYSA-N
XLogP3.01
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.34
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [3-fluoro-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-4-pyridinyl]methanamine?
The IUPAC name of [3-fluoro-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-4-pyridinyl]methanamine (CID 105389866) is [3-fluoro-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-4-pyridinyl]methanamine.
What is the SMILES notation for [3-fluoro-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-4-pyridinyl]methanamine?
The canonical SMILES for [3-fluoro-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-4-pyridinyl]methanamine is CC1Cc2ccccc2N(c2nccc(CN)c2F)C1.
What is the InChIKey of [3-fluoro-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-4-pyridinyl]methanamine?
The InChIKey is OAKKOFRQNQRQJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18FN3/c1-11-8-12-4-2-3-5-14(12)20(10-11)16-15(17)13(9-18)6-7-19-16/h2-7,11H,8-10,18H2,1H3.
What are the key properties of [3-fluoro-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-4-pyridinyl]methanamine?
[3-fluoro-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-4-pyridinyl]methanamine has a molecular weight of 271.34 g/mol, XLogP of 3.01, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-fluoro-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-4-pyridinyl]methanamine is sourced from PubChem (CID 105389866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).