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

C17H19FN2 — CID 63551419

IUPAC[5-fluoro-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]methanamine
SMILESCC1Cc2ccccc2N(c2ccc(F)cc2CN)C1
InChIInChI=1S/C17H19FN2/c1-12-8-13-4-2-3-5-16(13)20(11-12)17-7-6-15(18)9-14(17)10-19/h2-7,9,12H,8,10-11,19H2,1H3
InChIKeyCXXUJFYEOXMDKQ-UHFFFAOYSA-N
MW270.35 g/mol
LogP3.61
Rot. Bonds2

About [5-fluoro-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]methanamine

[5-fluoro-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]methanamine (PubChem CID 63551419) has the molecular formula C17H19FN2 and a molecular weight of 270.35 g/mol. Its IUPAC name is [5-fluoro-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]methanamine.

Molecular Properties

Compound Name[5-fluoro-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]methanamine
PubChem CID63551419
Molecular FormulaC17H19FN2
Molecular Weight270.35 g/mol
Exact Mass270.15
IUPAC Name[5-fluoro-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]methanamine
SMILESCC1Cc2ccccc2N(c2ccc(F)cc2CN)C1
InChIInChI=1S/C17H19FN2/c1-12-8-13-4-2-3-5-16(13)20(11-12)17-7-6-15(18)9-14(17)10-19/h2-7,9,12H,8,10-11,19H2,1H3
InChIKeyCXXUJFYEOXMDKQ-UHFFFAOYSA-N
XLogP3.61
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.35
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1S)-1-[5-fluoro-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]ethanamine
CID 78944403
[2-(2,3-dihydroindol-1-yl)-5-fluorophenyl]methanamine
CID 43313804
5-fluoro-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)benzoic acid
CID 63535830
[3-fluoro-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-4-pyridinyl]methanamine
CID 105389866
2-[3-fluoro-5-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]ethanamine
CID 106532388
[5-fluoro-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]phenyl]methanamine
CID 63288980
[2-(1,3-dihydroisoindol-2-yl)-5-fluorophenyl]methanamine
CID 55049952
1-[3-fluoro-5-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]-N-methylmethanamine
CID 106530990
1-[2-fluoro-6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]ethanamine
CID 63532709
4-bromo-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)aniline
CID 65342629
[4-chloro-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]methanol
CID 114845625
2-fluoro-6-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)benzenecarbothioamide
CID 79516134

Frequently Asked Questions

What is the IUPAC name of [5-fluoro-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]methanamine?
The IUPAC name of [5-fluoro-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]methanamine (CID 63551419) is [5-fluoro-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]methanamine.
What is the SMILES notation for [5-fluoro-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]methanamine?
The canonical SMILES for [5-fluoro-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]methanamine is CC1Cc2ccccc2N(c2ccc(F)cc2CN)C1.
What is the InChIKey of [5-fluoro-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]methanamine?
The InChIKey is CXXUJFYEOXMDKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN2/c1-12-8-13-4-2-3-5-16(13)20(11-12)17-7-6-15(18)9-14(17)10-19/h2-7,9,12H,8,10-11,19H2,1H3.
What are the key properties of [5-fluoro-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]methanamine?
[5-fluoro-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]methanamine has a molecular weight of 270.35 g/mol, XLogP of 3.61, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [5-fluoro-2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]methanamine is sourced from PubChem (CID 63551419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).