6-[2-[3-fluoro-5-[3-(methylaminomethyl)phenyl]phenyl]ethyl]-4-methylpyridin-2-amine

C22H24FN3 — CID 134686798

IUPAC6-[2-[3-fluoro-5-[3-(methylaminomethyl)phenyl]phenyl]ethyl]-4-methylpyridin-2-amine
SMILESCNCc1cccc(-c2cc(F)cc(CCc3cc(C)cc(N)n3)c2)c1
InChIInChI=1S/C22H24FN3/c1-15-8-21(26-22(24)9-15)7-6-16-10-19(13-20(23)12-16)18-5-3-4-17(11-18)14-25-2/h3-5,8-13,25H,6-7,14H2,1-2H3,(H2,24,26)
InChIKeyGVTRYBJMAVPTHT-UHFFFAOYSA-N
MW349.45 g/mol
LogP4.28
Rot. Bonds6

About 6-[2-[3-fluoro-5-[3-(methylaminomethyl)phenyl]phenyl]ethyl]-4-methylpyridin-2-amine

6-[2-[3-fluoro-5-[3-(methylaminomethyl)phenyl]phenyl]ethyl]-4-methylpyridin-2-amine (PubChem CID 134686798) has the molecular formula C22H24FN3 and a molecular weight of 349.45 g/mol. Its IUPAC name is 6-[2-[3-fluoro-5-[3-(methylaminomethyl)phenyl]phenyl]ethyl]-4-methylpyridin-2-amine.

Molecular Properties

Compound Name6-[2-[3-fluoro-5-[3-(methylaminomethyl)phenyl]phenyl]ethyl]-4-methylpyridin-2-amine
PubChem CID134686798
Molecular FormulaC22H24FN3
Molecular Weight349.45 g/mol
Exact Mass349.20
IUPAC Name6-[2-[3-fluoro-5-[3-(methylaminomethyl)phenyl]phenyl]ethyl]-4-methylpyridin-2-amine
SMILESCNCc1cccc(-c2cc(F)cc(CCc3cc(C)cc(N)n3)c2)c1
InChIInChI=1S/C22H24FN3/c1-15-8-21(26-22(24)9-15)7-6-16-10-19(13-20(23)12-16)18-5-3-4-17(11-18)14-25-2/h3-5,8-13,25H,6-7,14H2,1-2H3,(H2,24,26)
InChIKeyGVTRYBJMAVPTHT-UHFFFAOYSA-N
XLogP4.28
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.45
LogP ≤ 54.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-[2-(3-fluorophenyl)ethyl]-4-methylpyridin-2-amine;methane
CID 145078015
6-[2-[3-(aminomethyl)-5-[2-(6-amino-4-methyl-2-pyridinyl)ethyl]phenyl]ethyl]-4-methylpyridin-2-amine
CID 71260796
N-methyl-1-[3-(3,4,5-trifluorophenyl)phenyl]methanamine
CID 61239496
[3-[3-(methylaminomethyl)phenyl]phenyl]methanamine
CID 58788121
1-(3-fluorophenyl)-N-methylmethanamine;methane
CID 144941396
6-[[6-[[2-(3-fluorophenyl)ethylamino]methyl]-2-pyridinyl]methoxymethyl]-4-methylpyridin-2-amine
CID 71769669
3-[2-(6-amino-4-methyl-2-pyridinyl)ethyl]-5-[2-[4-methyl-6-(methylamino)-2-pyridinyl]ethyl]benzonitrile
CID 86346620
N-[[3-(3,5-difluorophenyl)phenyl]methyl]ethanamine
CID 54911880
7-methyl-5-[3-(methylaminomethyl)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 142547580
1-[3-(3,4-dimethylphenyl)phenyl]-N-methylmethanamine
CID 61034041
N-methyl-1-[3-[2-(3-methylphenyl)ethyl]phenyl]methanamine
CID 145495304
1-[4-(3-fluoro-5-methylphenyl)-3-methylphenyl]-N-methylmethanamine
CID 79690685

Frequently Asked Questions

What is the IUPAC name of 6-[2-[3-fluoro-5-[3-(methylaminomethyl)phenyl]phenyl]ethyl]-4-methylpyridin-2-amine?
The IUPAC name of 6-[2-[3-fluoro-5-[3-(methylaminomethyl)phenyl]phenyl]ethyl]-4-methylpyridin-2-amine (CID 134686798) is 6-[2-[3-fluoro-5-[3-(methylaminomethyl)phenyl]phenyl]ethyl]-4-methylpyridin-2-amine.
What is the SMILES notation for 6-[2-[3-fluoro-5-[3-(methylaminomethyl)phenyl]phenyl]ethyl]-4-methylpyridin-2-amine?
The canonical SMILES for 6-[2-[3-fluoro-5-[3-(methylaminomethyl)phenyl]phenyl]ethyl]-4-methylpyridin-2-amine is CNCc1cccc(-c2cc(F)cc(CCc3cc(C)cc(N)n3)c2)c1.
What is the InChIKey of 6-[2-[3-fluoro-5-[3-(methylaminomethyl)phenyl]phenyl]ethyl]-4-methylpyridin-2-amine?
The InChIKey is GVTRYBJMAVPTHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24FN3/c1-15-8-21(26-22(24)9-15)7-6-16-10-19(13-20(23)12-16)18-5-3-4-17(11-18)14-25-2/h3-5,8-13,25H,6-7,14H2,1-2H3,(H2,24,26).
What are the key properties of 6-[2-[3-fluoro-5-[3-(methylaminomethyl)phenyl]phenyl]ethyl]-4-methylpyridin-2-amine?
6-[2-[3-fluoro-5-[3-(methylaminomethyl)phenyl]phenyl]ethyl]-4-methylpyridin-2-amine has a molecular weight of 349.45 g/mol, XLogP of 4.28, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-[3-fluoro-5-[3-(methylaminomethyl)phenyl]phenyl]ethyl]-4-methylpyridin-2-amine is sourced from PubChem (CID 134686798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).