3,5-difluoro-N-(2-pyridin-2-ylethyl)pyridin-2-amine

C12H11F2N3 — CID 112675532

IUPAC3,5-difluoro-N-(2-pyridin-2-ylethyl)pyridin-2-amine
SMILESFc1cnc(NCCc2ccccn2)c(F)c1
InChIInChI=1S/C12H11F2N3/c13-9-7-11(14)12(17-8-9)16-6-4-10-3-1-2-5-15-10/h1-3,5,7-8H,4,6H2,(H,16,17)
InChIKeyHUZMMOYCUQOHGD-UHFFFAOYSA-N
MW235.24 g/mol
LogP2.41
Rot. Bonds4

About 3,5-difluoro-N-(2-pyridin-2-ylethyl)pyridin-2-amine

3,5-difluoro-N-(2-pyridin-2-ylethyl)pyridin-2-amine (PubChem CID 112675532) has the molecular formula C12H11F2N3 and a molecular weight of 235.24 g/mol. Its IUPAC name is 3,5-difluoro-N-(2-pyridin-2-ylethyl)pyridin-2-amine.

Molecular Properties

Compound Name3,5-difluoro-N-(2-pyridin-2-ylethyl)pyridin-2-amine
PubChem CID112675532
Molecular FormulaC12H11F2N3
Molecular Weight235.24 g/mol
Exact Mass235.09
IUPAC Name3,5-difluoro-N-(2-pyridin-2-ylethyl)pyridin-2-amine
SMILESFc1cnc(NCCc2ccccn2)c(F)c1
InChIInChI=1S/C12H11F2N3/c13-9-7-11(14)12(17-8-9)16-6-4-10-3-1-2-5-15-10/h1-3,5,7-8H,4,6H2,(H,16,17)
InChIKeyHUZMMOYCUQOHGD-UHFFFAOYSA-N
XLogP2.41
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.24
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,5-difluoro-N-(pyridin-2-ylmethyl)pyridin-2-amine
CID 112675579
2-bromo-4,6-difluoro-N-(2-pyridin-2-ylethyl)aniline
CID 60864008
5-chloro-2-fluoro-N-(2-pyridin-2-ylethyl)aniline
CID 60864899
2,3-difluoro-N-(2-pyridin-2-ylethyl)aniline
CID 61076812
3,5-difluoro-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]pyridin-2-amine
CID 114140629
N-(2-pyridin-2-ylethyl)pyrazin-2-amine
CID 28544593
2-chloro-4-fluoro-N-(2-pyridin-2-ylethyl)aniline
CID 60721568
3,5-difluoro-2-nitro-N-(2-pyridin-2-ylethyl)aniline
CID 115507663
4-bromo-5-fluoro-1-N-(2-pyridin-2-ylethyl)benzene-1,2-diamine
CID 66110681
3,5-difluoro-4-(2-pyridin-2-ylethylamino)benzonitrile
CID 78981152
N-(3,3-difluoropropyl)-3,5-difluoropyridin-2-amine
CID 127013338
N-[(4-fluorophenyl)methyl]-2-pyridin-2-ylethanamine
CID 13082717

Frequently Asked Questions

What is the IUPAC name of 3,5-difluoro-N-(2-pyridin-2-ylethyl)pyridin-2-amine?
The IUPAC name of 3,5-difluoro-N-(2-pyridin-2-ylethyl)pyridin-2-amine (CID 112675532) is 3,5-difluoro-N-(2-pyridin-2-ylethyl)pyridin-2-amine.
What is the SMILES notation for 3,5-difluoro-N-(2-pyridin-2-ylethyl)pyridin-2-amine?
The canonical SMILES for 3,5-difluoro-N-(2-pyridin-2-ylethyl)pyridin-2-amine is Fc1cnc(NCCc2ccccn2)c(F)c1.
What is the InChIKey of 3,5-difluoro-N-(2-pyridin-2-ylethyl)pyridin-2-amine?
The InChIKey is HUZMMOYCUQOHGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11F2N3/c13-9-7-11(14)12(17-8-9)16-6-4-10-3-1-2-5-15-10/h1-3,5,7-8H,4,6H2,(H,16,17).
What are the key properties of 3,5-difluoro-N-(2-pyridin-2-ylethyl)pyridin-2-amine?
3,5-difluoro-N-(2-pyridin-2-ylethyl)pyridin-2-amine has a molecular weight of 235.24 g/mol, XLogP of 2.41, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-difluoro-N-(2-pyridin-2-ylethyl)pyridin-2-amine is sourced from PubChem (CID 112675532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).