1-(4-fluorophenyl)-2-methyl-3-pyridin-4-ylpropan-2-amine

C15H17FN2 — CID 114833720

IUPAC1-(4-fluorophenyl)-2-methyl-3-pyridin-4-ylpropan-2-amine
SMILESCC(N)(Cc1ccncc1)Cc1ccc(F)cc1
InChIInChI=1S/C15H17FN2/c1-15(17,11-13-6-8-18-9-7-13)10-12-2-4-14(16)5-3-12/h2-9H,10-11,17H2,1H3
InChIKeyITJSCHNCGOAKRA-UHFFFAOYSA-N
MW244.31 g/mol
LogP2.72
Rot. Bonds4

About 1-(4-fluorophenyl)-2-methyl-3-pyridin-4-ylpropan-2-amine

1-(4-fluorophenyl)-2-methyl-3-pyridin-4-ylpropan-2-amine (PubChem CID 114833720) has the molecular formula C15H17FN2 and a molecular weight of 244.31 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-2-methyl-3-pyridin-4-ylpropan-2-amine.

Molecular Properties

Compound Name1-(4-fluorophenyl)-2-methyl-3-pyridin-4-ylpropan-2-amine
PubChem CID114833720
Molecular FormulaC15H17FN2
Molecular Weight244.31 g/mol
Exact Mass244.14
IUPAC Name1-(4-fluorophenyl)-2-methyl-3-pyridin-4-ylpropan-2-amine
SMILESCC(N)(Cc1ccncc1)Cc1ccc(F)cc1
InChIInChI=1S/C15H17FN2/c1-15(17,11-13-6-8-18-9-7-13)10-12-2-4-14(16)5-3-12/h2-9H,10-11,17H2,1H3
InChIKeyITJSCHNCGOAKRA-UHFFFAOYSA-N
XLogP2.72
TPSA38.91 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 ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3,4-dimethylphenyl)-3-(4-fluorophenyl)-2-methylpropan-2-amine
CID 114833802
2-methyl-1-pyridin-4-ylpropan-2-amine;hydrochloride
CID 141017506
1-(4-fluorophenyl)-2-methylpropan-2-amine;hydrochloride
CID 22597146
1-(2,5-difluorophenyl)-3-(4-fluorophenyl)-2-methylpropan-2-amine
CID 114833840
1-(4-fluorophenyl)-2-(3-methoxypyrazin-2-yl)propan-2-amine
CID 114833857
1-(4-fluorophenyl)-2-pyrimidin-2-ylpropan-2-amine
CID 165485022
4-[2-amino-3-(4-aminophenyl)-2-methylpropyl]aniline
CID 54001373
4-(2,2-dimethylpropyl)pyridine
CID 22960904
1-(4-chloro-2-fluorophenyl)-3-(4-fluorophenyl)-2-methylpropan-2-amine
CID 114853577
1-(4-fluorophenyl)-2-[4-(trifluoromethyl)phenyl]propan-2-amine
CID 114833903
1-(5-chloro-1,3-dimethylpyrazol-4-yl)-3-(4-fluorophenyl)-2-methylpropan-2-amine
CID 114833904
2-(4-amino-3-pyridinyl)-1-(4-fluorophenyl)propan-2-ol
CID 114833173

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-2-methyl-3-pyridin-4-ylpropan-2-amine?
The IUPAC name of 1-(4-fluorophenyl)-2-methyl-3-pyridin-4-ylpropan-2-amine (CID 114833720) is 1-(4-fluorophenyl)-2-methyl-3-pyridin-4-ylpropan-2-amine.
What is the SMILES notation for 1-(4-fluorophenyl)-2-methyl-3-pyridin-4-ylpropan-2-amine?
The canonical SMILES for 1-(4-fluorophenyl)-2-methyl-3-pyridin-4-ylpropan-2-amine is CC(N)(Cc1ccncc1)Cc1ccc(F)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-2-methyl-3-pyridin-4-ylpropan-2-amine?
The InChIKey is ITJSCHNCGOAKRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN2/c1-15(17,11-13-6-8-18-9-7-13)10-12-2-4-14(16)5-3-12/h2-9H,10-11,17H2,1H3.
What are the key properties of 1-(4-fluorophenyl)-2-methyl-3-pyridin-4-ylpropan-2-amine?
1-(4-fluorophenyl)-2-methyl-3-pyridin-4-ylpropan-2-amine has a molecular weight of 244.31 g/mol, XLogP of 2.72, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-2-methyl-3-pyridin-4-ylpropan-2-amine is sourced from PubChem (CID 114833720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).