N-[1-(2,5-difluorophenyl)ethyl]-1-pyridin-2-ylethanamine

C15H16F2N2 — CID 43202625

IUPACN-[1-(2,5-difluorophenyl)ethyl]-1-pyridin-2-ylethanamine
SMILESCC(NC(C)c1cc(F)ccc1F)c1ccccn1
InChIInChI=1S/C15H16F2N2/c1-10(13-9-12(16)6-7-14(13)17)19-11(2)15-5-3-4-8-18-15/h3-11,19H,1-2H3
InChIKeyABOZRGJABUJFGZ-UHFFFAOYSA-N
MW262.30 g/mol
LogP3.77
Rot. Bonds4

About N-[1-(2,5-difluorophenyl)ethyl]-1-pyridin-2-ylethanamine

N-[1-(2,5-difluorophenyl)ethyl]-1-pyridin-2-ylethanamine (PubChem CID 43202625) has the molecular formula C15H16F2N2 and a molecular weight of 262.30 g/mol. Its IUPAC name is N-[1-(2,5-difluorophenyl)ethyl]-1-pyridin-2-ylethanamine.

Molecular Properties

Compound NameN-[1-(2,5-difluorophenyl)ethyl]-1-pyridin-2-ylethanamine
PubChem CID43202625
Molecular FormulaC15H16F2N2
Molecular Weight262.30 g/mol
Exact Mass262.13
IUPAC NameN-[1-(2,5-difluorophenyl)ethyl]-1-pyridin-2-ylethanamine
SMILESCC(NC(C)c1cc(F)ccc1F)c1ccccn1
InChIInChI=1S/C15H16F2N2/c1-10(13-9-12(16)6-7-14(13)17)19-11(2)15-5-3-4-8-18-15/h3-11,19H,1-2H3
InChIKeyABOZRGJABUJFGZ-UHFFFAOYSA-N
XLogP3.77
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.30
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-chloro-4-fluorophenyl)-N-[(1S)-1-pyridin-2-ylethyl]ethanamine
CID 81401324
1-(2-bromo-4-fluorophenyl)-N-[(1S)-1-pyridin-2-ylethyl]ethanamine
CID 103931399
1-(2,5-difluorophenyl)-2-(1-pyridin-2-ylethylamino)ethanol
CID 60909735
1-(3-fluorophenyl)-N-[(1R)-1-pyridin-2-ylethyl]ethanamine
CID 81402285
(1R)-1-(3-fluorophenyl)-N-(1-pyridin-2-ylethyl)ethanamine
CID 81367216
3-fluoro-4-[1-(1-pyridin-2-ylethylamino)ethyl]phenol
CID 107714620
1-(3-fluoro-4-methylphenyl)-N-[(1S)-1-pyridin-2-ylethyl]ethanamine
CID 81401331
1-(2,4-difluorophenyl)-N-[1-(2,5-difluorophenyl)ethyl]ethanamine
CID 43674206
1-(2-bromophenyl)-N-[1-(2,5-difluorophenyl)ethyl]ethanamine
CID 43674233
(1S)-1-(2-bromophenyl)-N-[1-(2,5-difluorophenyl)ethyl]ethanamine
CID 81383317
1-(2-methylphenyl)-N-(1-pyridin-2-ylethyl)ethanamine
CID 43203224
1-(4-chlorophenyl)-N-(1-pyridin-2-ylethyl)ethanamine
CID 43202325

Frequently Asked Questions

What is the IUPAC name of N-[1-(2,5-difluorophenyl)ethyl]-1-pyridin-2-ylethanamine?
The IUPAC name of N-[1-(2,5-difluorophenyl)ethyl]-1-pyridin-2-ylethanamine (CID 43202625) is N-[1-(2,5-difluorophenyl)ethyl]-1-pyridin-2-ylethanamine.
What is the SMILES notation for N-[1-(2,5-difluorophenyl)ethyl]-1-pyridin-2-ylethanamine?
The canonical SMILES for N-[1-(2,5-difluorophenyl)ethyl]-1-pyridin-2-ylethanamine is CC(NC(C)c1cc(F)ccc1F)c1ccccn1.
What is the InChIKey of N-[1-(2,5-difluorophenyl)ethyl]-1-pyridin-2-ylethanamine?
The InChIKey is ABOZRGJABUJFGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16F2N2/c1-10(13-9-12(16)6-7-14(13)17)19-11(2)15-5-3-4-8-18-15/h3-11,19H,1-2H3.
What are the key properties of N-[1-(2,5-difluorophenyl)ethyl]-1-pyridin-2-ylethanamine?
N-[1-(2,5-difluorophenyl)ethyl]-1-pyridin-2-ylethanamine has a molecular weight of 262.30 g/mol, XLogP of 3.77, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2,5-difluorophenyl)ethyl]-1-pyridin-2-ylethanamine is sourced from PubChem (CID 43202625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).