2-(4-fluoro-3-methylphenyl)-N-methyl-2-pyridin-4-ylethanamine

C15H17FN2 — CID 116824907

IUPAC2-(4-fluoro-3-methylphenyl)-N-methyl-2-pyridin-4-ylethanamine
SMILESCNCC(c1ccncc1)c1ccc(F)c(C)c1
InChIInChI=1S/C15H17FN2/c1-11-9-13(3-4-15(11)16)14(10-17-2)12-5-7-18-8-6-12/h3-9,14,17H,10H2,1-2H3
InChIKeyQVPOKBMISIMFCZ-UHFFFAOYSA-N
MW244.31 g/mol
LogP2.88
Rot. Bonds4

About 2-(4-fluoro-3-methylphenyl)-N-methyl-2-pyridin-4-ylethanamine

2-(4-fluoro-3-methylphenyl)-N-methyl-2-pyridin-4-ylethanamine (PubChem CID 116824907) has the molecular formula C15H17FN2 and a molecular weight of 244.31 g/mol. Its IUPAC name is 2-(4-fluoro-3-methylphenyl)-N-methyl-2-pyridin-4-ylethanamine.

Molecular Properties

Compound Name2-(4-fluoro-3-methylphenyl)-N-methyl-2-pyridin-4-ylethanamine
PubChem CID116824907
Molecular FormulaC15H17FN2
Molecular Weight244.31 g/mol
Exact Mass244.14
IUPAC Name2-(4-fluoro-3-methylphenyl)-N-methyl-2-pyridin-4-ylethanamine
SMILESCNCC(c1ccncc1)c1ccc(F)c(C)c1
InChIInChI=1S/C15H17FN2/c1-11-9-13(3-4-15(11)16)14(10-17-2)12-5-7-18-8-6-12/h3-9,14,17H,10H2,1-2H3
InChIKeyQVPOKBMISIMFCZ-UHFFFAOYSA-N
XLogP2.88
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.31
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-2,2-dipyridin-4-ylethanamine
CID 116824958
2-(5-bromo-2-fluorophenyl)-N-methyl-2-pyridin-4-ylethanamine
CID 116824951
N-methyl-2-pyridin-4-yl-2-(2,4,5-trimethylphenyl)ethanamine
CID 116824934
N-methyl-2-pyridin-4-yl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanamine
CID 116824902
2-(4-fluoro-3-methylphenyl)-2-(1H-imidazol-2-yl)ethanol
CID 68678189
(1S)-N-[(4-fluoro-3-methylphenyl)methyl]-1-pyridin-4-ylethanamine
CID 81406046
2-fluoro-N-methyl-2-pyridin-4-ylethanamine
CID 83853523
1-(4-fluoro-3-methylphenyl)-N-methylpropan-1-amine
CID 60929376
1-(4-fluoro-3-methylphenyl)-N'-methylpropane-1,3-diamine
CID 116932886
1-(4-fluoro-3-methylphenyl)-N'-methylmethanediamine
CID 116939268
(4-fluoro-3-methylphenyl)methanediol
CID 45090626
(4-fluoro-3-methylphenyl)-pyrimidin-4-ylmethanamine
CID 63989151

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluoro-3-methylphenyl)-N-methyl-2-pyridin-4-ylethanamine?
The IUPAC name of 2-(4-fluoro-3-methylphenyl)-N-methyl-2-pyridin-4-ylethanamine (CID 116824907) is 2-(4-fluoro-3-methylphenyl)-N-methyl-2-pyridin-4-ylethanamine.
What is the SMILES notation for 2-(4-fluoro-3-methylphenyl)-N-methyl-2-pyridin-4-ylethanamine?
The canonical SMILES for 2-(4-fluoro-3-methylphenyl)-N-methyl-2-pyridin-4-ylethanamine is CNCC(c1ccncc1)c1ccc(F)c(C)c1.
What is the InChIKey of 2-(4-fluoro-3-methylphenyl)-N-methyl-2-pyridin-4-ylethanamine?
The InChIKey is QVPOKBMISIMFCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN2/c1-11-9-13(3-4-15(11)16)14(10-17-2)12-5-7-18-8-6-12/h3-9,14,17H,10H2,1-2H3.
What are the key properties of 2-(4-fluoro-3-methylphenyl)-N-methyl-2-pyridin-4-ylethanamine?
2-(4-fluoro-3-methylphenyl)-N-methyl-2-pyridin-4-ylethanamine has a molecular weight of 244.31 g/mol, XLogP of 2.88, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluoro-3-methylphenyl)-N-methyl-2-pyridin-4-ylethanamine is sourced from PubChem (CID 116824907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).