1-(2,5-difluorophenyl)-N-methyl-1-quinolin-2-ylmethanamine

C17H14F2N2 — CID 63222517

IUPAC1-(2,5-difluorophenyl)-N-methyl-1-quinolin-2-ylmethanamine
SMILESCNC(c1ccc2ccccc2n1)c1cc(F)ccc1F
InChIInChI=1S/C17H14F2N2/c1-20-17(13-10-12(18)7-8-14(13)19)16-9-6-11-4-2-3-5-15(11)21-16/h2-10,17,20H,1H3
InChIKeyMGCDLVRBXIDYIS-UHFFFAOYSA-N
MW284.31 g/mol
LogP3.82
Rot. Bonds3

About 1-(2,5-difluorophenyl)-N-methyl-1-quinolin-2-ylmethanamine

1-(2,5-difluorophenyl)-N-methyl-1-quinolin-2-ylmethanamine (PubChem CID 63222517) has the molecular formula C17H14F2N2 and a molecular weight of 284.31 g/mol. Its IUPAC name is 1-(2,5-difluorophenyl)-N-methyl-1-quinolin-2-ylmethanamine.

Molecular Properties

Compound Name1-(2,5-difluorophenyl)-N-methyl-1-quinolin-2-ylmethanamine
PubChem CID63222517
Molecular FormulaC17H14F2N2
Molecular Weight284.31 g/mol
Exact Mass284.11
IUPAC Name1-(2,5-difluorophenyl)-N-methyl-1-quinolin-2-ylmethanamine
SMILESCNC(c1ccc2ccccc2n1)c1cc(F)ccc1F
InChIInChI=1S/C17H14F2N2/c1-20-17(13-10-12(18)7-8-14(13)19)16-9-6-11-4-2-3-5-15(11)21-16/h2-10,17,20H,1H3
InChIKeyMGCDLVRBXIDYIS-UHFFFAOYSA-N
XLogP3.82
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.31
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(5-fluoro-3-pyridinyl)-N-methyl-1-quinolin-2-ylmethanamine
CID 63222854
1-(2,3-dimethylphenyl)-N-methyl-1-quinolin-2-ylmethanamine
CID 63222475
N-methyl-1-(2-methylthiophen-3-yl)-1-quinolin-2-ylmethanamine
CID 102832467
1-(1-benzofuran-2-yl)-1-(2,5-difluorophenyl)-N-methylmethanamine
CID 63089727
1-(2,5-difluorophenyl)-1-(2,6-difluorophenyl)-N-methylmethanamine
CID 43482919
N-[(4-fluorophenyl)-quinolin-2-ylmethyl]ethanamine
CID 63222518
1-(2,5-difluorophenyl)-N-methyl-1-(1-methylimidazol-4-yl)methanamine
CID 107974970
1-(2,5-difluorophenyl)-1-(3,4-difluorophenyl)-N-methylmethanamine
CID 43482905
1-(5-bromo-2-fluorophenyl)-1-(2,5-difluorophenyl)-N-methylmethanamine
CID 43482895
1-(2,5-difluorophenyl)-N-methyl-1-(2,4,5-trimethylphenyl)methanamine
CID 64989656
bis(2-(2,4-difluorophenyl)quinoline);iridium
CID 175385280
1-(2-chloro-4-fluorophenyl)-1-(2,5-difluorophenyl)-N-methylmethanamine
CID 43482921

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-difluorophenyl)-N-methyl-1-quinolin-2-ylmethanamine?
The IUPAC name of 1-(2,5-difluorophenyl)-N-methyl-1-quinolin-2-ylmethanamine (CID 63222517) is 1-(2,5-difluorophenyl)-N-methyl-1-quinolin-2-ylmethanamine.
What is the SMILES notation for 1-(2,5-difluorophenyl)-N-methyl-1-quinolin-2-ylmethanamine?
The canonical SMILES for 1-(2,5-difluorophenyl)-N-methyl-1-quinolin-2-ylmethanamine is CNC(c1ccc2ccccc2n1)c1cc(F)ccc1F.
What is the InChIKey of 1-(2,5-difluorophenyl)-N-methyl-1-quinolin-2-ylmethanamine?
The InChIKey is MGCDLVRBXIDYIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14F2N2/c1-20-17(13-10-12(18)7-8-14(13)19)16-9-6-11-4-2-3-5-15(11)21-16/h2-10,17,20H,1H3.
What are the key properties of 1-(2,5-difluorophenyl)-N-methyl-1-quinolin-2-ylmethanamine?
1-(2,5-difluorophenyl)-N-methyl-1-quinolin-2-ylmethanamine has a molecular weight of 284.31 g/mol, XLogP of 3.82, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-difluorophenyl)-N-methyl-1-quinolin-2-ylmethanamine is sourced from PubChem (CID 63222517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).