2-(3,5-difluorophenyl)-1-(2,6-dimethyl-4-pyridinyl)ethanamine

C15H16F2N2 — CID 107503055

IUPAC2-(3,5-difluorophenyl)-1-(2,6-dimethyl-4-pyridinyl)ethanamine
SMILESCc1cc(C(N)Cc2cc(F)cc(F)c2)cc(C)n1
InChIInChI=1S/C15H16F2N2/c1-9-3-12(4-10(2)19-9)15(18)7-11-5-13(16)8-14(17)6-11/h3-6,8,15H,7,18H2,1-2H3
InChIKeyFBJAQXIDLJPTHQ-UHFFFAOYSA-N
MW262.30 g/mol
LogP3.22
Rot. Bonds3

About 2-(3,5-difluorophenyl)-1-(2,6-dimethyl-4-pyridinyl)ethanamine

2-(3,5-difluorophenyl)-1-(2,6-dimethyl-4-pyridinyl)ethanamine (PubChem CID 107503055) has the molecular formula C15H16F2N2 and a molecular weight of 262.30 g/mol. Its IUPAC name is 2-(3,5-difluorophenyl)-1-(2,6-dimethyl-4-pyridinyl)ethanamine.

Molecular Properties

Compound Name2-(3,5-difluorophenyl)-1-(2,6-dimethyl-4-pyridinyl)ethanamine
PubChem CID107503055
Molecular FormulaC15H16F2N2
Molecular Weight262.30 g/mol
Exact Mass262.13
IUPAC Name2-(3,5-difluorophenyl)-1-(2,6-dimethyl-4-pyridinyl)ethanamine
SMILESCc1cc(C(N)Cc2cc(F)cc(F)c2)cc(C)n1
InChIInChI=1S/C15H16F2N2/c1-9-3-12(4-10(2)19-9)15(18)7-11-5-13(16)8-14(17)6-11/h3-6,8,15H,7,18H2,1-2H3
InChIKeyFBJAQXIDLJPTHQ-UHFFFAOYSA-N
XLogP3.22
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.30
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-bromo-5-fluorophenyl)-1-(3,5-dimethylphenyl)ethanamine
CID 105015396
2-(2-chloro-5-fluorophenyl)-1-(2,6-dimethyl-4-pyridinyl)ethanamine
CID 107503345
(1S)-1-(2,6-dimethyl-4-pyridinyl)propan-1-amine
CID 107504745
2-(2,3-difluorophenyl)-1-(2,6-dimethyl-4-pyridinyl)ethanamine
CID 107503218
2-(2,3-dihydro-1H-inden-5-yl)-1-(2,6-dimethyl-4-pyridinyl)ethanamine
CID 107503122
1-(3,5-difluorophenyl)-2-(4-methoxyphenyl)ethanamine
CID 61079796
1-(2,6-dimethyl-4-pyridinyl)-2-(1-ethylpyrazol-4-yl)ethanamine
CID 107503308
2-(3,5-difluorophenyl)-1-pyridin-3-ylethanamine
CID 54959804
1,2-bis(3,5-dimethylphenyl)ethanamine
CID 55096005
1-(2,6-dimethyl-4-pyridinyl)-2-methoxyethanamine
CID 107503103
1-(2,6-dimethyl-4-pyridinyl)-2-(5-ethyl-2-pyridinyl)ethanamine
CID 107503102
4-(3,5-difluorophenyl)-3-methylbutan-2-amine
CID 105404517

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-difluorophenyl)-1-(2,6-dimethyl-4-pyridinyl)ethanamine?
The IUPAC name of 2-(3,5-difluorophenyl)-1-(2,6-dimethyl-4-pyridinyl)ethanamine (CID 107503055) is 2-(3,5-difluorophenyl)-1-(2,6-dimethyl-4-pyridinyl)ethanamine.
What is the SMILES notation for 2-(3,5-difluorophenyl)-1-(2,6-dimethyl-4-pyridinyl)ethanamine?
The canonical SMILES for 2-(3,5-difluorophenyl)-1-(2,6-dimethyl-4-pyridinyl)ethanamine is Cc1cc(C(N)Cc2cc(F)cc(F)c2)cc(C)n1.
What is the InChIKey of 2-(3,5-difluorophenyl)-1-(2,6-dimethyl-4-pyridinyl)ethanamine?
The InChIKey is FBJAQXIDLJPTHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16F2N2/c1-9-3-12(4-10(2)19-9)15(18)7-11-5-13(16)8-14(17)6-11/h3-6,8,15H,7,18H2,1-2H3.
What are the key properties of 2-(3,5-difluorophenyl)-1-(2,6-dimethyl-4-pyridinyl)ethanamine?
2-(3,5-difluorophenyl)-1-(2,6-dimethyl-4-pyridinyl)ethanamine has a molecular weight of 262.30 g/mol, XLogP of 3.22, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-difluorophenyl)-1-(2,6-dimethyl-4-pyridinyl)ethanamine is sourced from PubChem (CID 107503055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).