1-(3,5-difluorophenyl)-2-(5-ethyl-2-pyridinyl)ethanamine

C15H16F2N2 — CID 79747813

IUPAC1-(3,5-difluorophenyl)-2-(5-ethyl-2-pyridinyl)ethanamine
SMILESCCc1ccc(CC(N)c2cc(F)cc(F)c2)nc1
InChIInChI=1S/C15H16F2N2/c1-2-10-3-4-14(19-9-10)8-15(18)11-5-12(16)7-13(17)6-11/h3-7,9,15H,2,8,18H2,1H3
InChIKeyQMMZWHPHPJTGLK-UHFFFAOYSA-N
MW262.30 g/mol
LogP3.16
Rot. Bonds4

About 1-(3,5-difluorophenyl)-2-(5-ethyl-2-pyridinyl)ethanamine

1-(3,5-difluorophenyl)-2-(5-ethyl-2-pyridinyl)ethanamine (PubChem CID 79747813) has the molecular formula C15H16F2N2 and a molecular weight of 262.30 g/mol. Its IUPAC name is 1-(3,5-difluorophenyl)-2-(5-ethyl-2-pyridinyl)ethanamine.

Molecular Properties

Compound Name1-(3,5-difluorophenyl)-2-(5-ethyl-2-pyridinyl)ethanamine
PubChem CID79747813
Molecular FormulaC15H16F2N2
Molecular Weight262.30 g/mol
Exact Mass262.13
IUPAC Name1-(3,5-difluorophenyl)-2-(5-ethyl-2-pyridinyl)ethanamine
SMILESCCc1ccc(CC(N)c2cc(F)cc(F)c2)nc1
InChIInChI=1S/C15H16F2N2/c1-2-10-3-4-14(19-9-10)8-15(18)11-5-12(16)7-13(17)6-11/h3-7,9,15H,2,8,18H2,1H3
InChIKeyQMMZWHPHPJTGLK-UHFFFAOYSA-N
XLogP3.16
TPSA38.91 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 ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-bromo-5-fluorophenyl)-2-(5-ethyl-2-pyridinyl)ethanamine
CID 79748010
1-(2,6-dimethyl-4-pyridinyl)-2-(5-ethyl-2-pyridinyl)ethanamine
CID 107503102
1-(4-bromo-3,5-dimethylphenyl)-2-(5-ethyl-2-pyridinyl)ethanamine
CID 114330207
2-(5-ethyl-2-pyridinyl)-1-(5-methyl-3-pyridinyl)ethanamine
CID 105168972
1-(3,5-difluorophenyl)-3-(5-ethyl-2-pyridinyl)propan-2-ol
CID 79745103
1-(4-bromo-2,6-difluorophenyl)-2-(5-ethyl-2-pyridinyl)ethanamine
CID 105014806
1-(3-chlorophenyl)-2-(5-ethyl-2-pyridinyl)ethanamine
CID 79747791
1-(3,5-difluorophenyl)-3-(5-ethyl-2-pyridinyl)-N-methylpropan-2-amine
CID 79732696
1-(3-bromo-5-fluorophenyl)-N-ethyl-2-(5-ethyl-2-pyridinyl)ethanamine
CID 79740670
1-(3,5-dichloro-2-pyridinyl)-2-(5-ethyl-2-pyridinyl)ethanamine
CID 79780214
N-ethyl-2-(5-ethyl-2-pyridinyl)-1-(3-fluorophenyl)ethanamine
CID 79745845
1-(5-chloro-2-methylphenyl)-2-(5-ethyl-2-pyridinyl)ethanamine
CID 105014621

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-difluorophenyl)-2-(5-ethyl-2-pyridinyl)ethanamine?
The IUPAC name of 1-(3,5-difluorophenyl)-2-(5-ethyl-2-pyridinyl)ethanamine (CID 79747813) is 1-(3,5-difluorophenyl)-2-(5-ethyl-2-pyridinyl)ethanamine.
What is the SMILES notation for 1-(3,5-difluorophenyl)-2-(5-ethyl-2-pyridinyl)ethanamine?
The canonical SMILES for 1-(3,5-difluorophenyl)-2-(5-ethyl-2-pyridinyl)ethanamine is CCc1ccc(CC(N)c2cc(F)cc(F)c2)nc1.
What is the InChIKey of 1-(3,5-difluorophenyl)-2-(5-ethyl-2-pyridinyl)ethanamine?
The InChIKey is QMMZWHPHPJTGLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16F2N2/c1-2-10-3-4-14(19-9-10)8-15(18)11-5-12(16)7-13(17)6-11/h3-7,9,15H,2,8,18H2,1H3.
What are the key properties of 1-(3,5-difluorophenyl)-2-(5-ethyl-2-pyridinyl)ethanamine?
1-(3,5-difluorophenyl)-2-(5-ethyl-2-pyridinyl)ethanamine has a molecular weight of 262.30 g/mol, XLogP of 3.16, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-difluorophenyl)-2-(5-ethyl-2-pyridinyl)ethanamine is sourced from PubChem (CID 79747813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).