2-(3-fluorophenyl)-1-pyridin-3-ylbutan-2-amine

C15H17FN2 — CID 114872773

IUPAC2-(3-fluorophenyl)-1-pyridin-3-ylbutan-2-amine
SMILESCCC(N)(Cc1cccnc1)c1cccc(F)c1
InChIInChI=1S/C15H17FN2/c1-2-15(17,10-12-5-4-8-18-11-12)13-6-3-7-14(16)9-13/h3-9,11H,2,10,17H2,1H3
InChIKeyRPEVYYKMBZURGB-UHFFFAOYSA-N
MW244.31 g/mol
LogP3.03
Rot. Bonds4

About 2-(3-fluorophenyl)-1-pyridin-3-ylbutan-2-amine

2-(3-fluorophenyl)-1-pyridin-3-ylbutan-2-amine (PubChem CID 114872773) has the molecular formula C15H17FN2 and a molecular weight of 244.31 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-1-pyridin-3-ylbutan-2-amine.

Molecular Properties

Compound Name2-(3-fluorophenyl)-1-pyridin-3-ylbutan-2-amine
PubChem CID114872773
Molecular FormulaC15H17FN2
Molecular Weight244.31 g/mol
Exact Mass244.14
IUPAC Name2-(3-fluorophenyl)-1-pyridin-3-ylbutan-2-amine
SMILESCCC(N)(Cc1cccnc1)c1cccc(F)c1
InChIInChI=1S/C15H17FN2/c1-2-15(17,10-12-5-4-8-18-11-12)13-6-3-7-14(16)9-13/h3-9,11H,2,10,17H2,1H3
InChIKeyRPEVYYKMBZURGB-UHFFFAOYSA-N
XLogP3.03
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 ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-bromo-5-fluorophenyl)-2-(3-fluorophenyl)butan-2-amine
CID 114872661
2-(3-fluorophenyl)-1-(4-propan-2-ylphenyl)butan-2-amine
CID 114872632
2-(3-fluorophenyl)-1-(4-methyl-1,3-thiazol-2-yl)butan-2-amine
CID 114872618
1-(2-chlorophenyl)-2-(3-fluorophenyl)butan-2-amine
CID 114872708
2-(3-fluoro-5-methylphenyl)-1-phenylbutan-2-amine
CID 79703833
3-[1-(4-fluorophenyl)-1,2-dipyridin-3-ylethyl]pyridine
CID 67011551
2-(3-chlorophenyl)-1-pyridin-3-ylpropan-2-amine
CID 104735876
2-(3-fluorophenyl)-1-(2-propan-2-yl-1,2,4-triazol-3-yl)butan-2-amine
CID 114872762
1,1-bis(4-fluorophenyl)-2-pyridin-3-ylethanol
CID 23036417
2-methyl-1-pyridin-3-ylpropan-2-amine;dihydrochloride
CID 131637820
1,2-bis(3-fluorophenyl)propan-2-amine
CID 60799225
2-(4-fluoro-3-methylphenyl)-1-phenylbutan-2-amine
CID 79007872

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-1-pyridin-3-ylbutan-2-amine?
The IUPAC name of 2-(3-fluorophenyl)-1-pyridin-3-ylbutan-2-amine (CID 114872773) is 2-(3-fluorophenyl)-1-pyridin-3-ylbutan-2-amine.
What is the SMILES notation for 2-(3-fluorophenyl)-1-pyridin-3-ylbutan-2-amine?
The canonical SMILES for 2-(3-fluorophenyl)-1-pyridin-3-ylbutan-2-amine is CCC(N)(Cc1cccnc1)c1cccc(F)c1.
What is the InChIKey of 2-(3-fluorophenyl)-1-pyridin-3-ylbutan-2-amine?
The InChIKey is RPEVYYKMBZURGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN2/c1-2-15(17,10-12-5-4-8-18-11-12)13-6-3-7-14(16)9-13/h3-9,11H,2,10,17H2,1H3.
What are the key properties of 2-(3-fluorophenyl)-1-pyridin-3-ylbutan-2-amine?
2-(3-fluorophenyl)-1-pyridin-3-ylbutan-2-amine has a molecular weight of 244.31 g/mol, XLogP of 3.03, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-1-pyridin-3-ylbutan-2-amine is sourced from PubChem (CID 114872773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).