N-[(3,5-difluorophenyl)-(4-methyl-3-pyridinyl)methyl]ethanamine

C15H16F2N2 — CID 66272491

IUPACN-[(3,5-difluorophenyl)-(4-methyl-3-pyridinyl)methyl]ethanamine
SMILESCCNC(c1cc(F)cc(F)c1)c1cnccc1C
InChIInChI=1S/C15H16F2N2/c1-3-19-15(14-9-18-5-4-10(14)2)11-6-12(16)8-13(17)7-11/h4-9,15,19H,3H2,1-2H3
InChIKeyUHHNCLPNYVGBSC-UHFFFAOYSA-N
MW262.30 g/mol
LogP3.37
Rot. Bonds4

About N-[(3,5-difluorophenyl)-(4-methyl-3-pyridinyl)methyl]ethanamine

N-[(3,5-difluorophenyl)-(4-methyl-3-pyridinyl)methyl]ethanamine (PubChem CID 66272491) has the molecular formula C15H16F2N2 and a molecular weight of 262.30 g/mol. Its IUPAC name is N-[(3,5-difluorophenyl)-(4-methyl-3-pyridinyl)methyl]ethanamine.

Molecular Properties

Compound NameN-[(3,5-difluorophenyl)-(4-methyl-3-pyridinyl)methyl]ethanamine
PubChem CID66272491
Molecular FormulaC15H16F2N2
Molecular Weight262.30 g/mol
Exact Mass262.13
IUPAC NameN-[(3,5-difluorophenyl)-(4-methyl-3-pyridinyl)methyl]ethanamine
SMILESCCNC(c1cc(F)cc(F)c1)c1cnccc1C
InChIInChI=1S/C15H16F2N2/c1-3-19-15(14-9-18-5-4-10(14)2)11-6-12(16)8-13(17)7-11/h4-9,15,19H,3H2,1-2H3
InChIKeyUHHNCLPNYVGBSC-UHFFFAOYSA-N
XLogP3.37
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 ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(4-bromo-3,5-dimethylphenyl)-(4-methyl-3-pyridinyl)methyl]ethanamine
CID 114330731
N-[(3,5-difluorophenyl)-(4-fluoro-2-methylphenyl)methyl]ethanamine
CID 62790553
N-[(3,5-difluorophenyl)-pyrimidin-4-ylmethyl]ethanamine
CID 63987713
1-(3-bromo-5-fluorophenyl)-N-methyl-1-(4-methyl-3-pyridinyl)methanamine
CID 66426235
N-[(3,5-dimethylphenyl)-(4-methyl-3-pyridinyl)methyl]propan-1-amine
CID 114878570
N-[(3-fluoro-4-pyridinyl)-(3,4,5-trifluorophenyl)methyl]ethanamine
CID 104738170
N-[(3,5-difluorophenyl)-pyrimidin-5-ylmethyl]ethanamine
CID 62491730
N-[(3-fluoro-4-methylphenyl)-(4-methyl-3-pyridinyl)methyl]propan-1-amine
CID 66270988
N-[(3,5-difluorophenyl)-pyrazolo[1,5-a]pyrazin-3-ylmethyl]ethanamine
CID 103126944
N-[(4-methyl-3-pyridinyl)-(3-methylsulfonylphenyl)methyl]ethanamine
CID 105006568
N-[(2,4-dichlorophenyl)-(4-methyl-3-pyridinyl)methyl]ethanamine
CID 105006477
N-[(4-methyl-3-pyridinyl)-pyridin-4-ylmethyl]propan-1-amine
CID 66271195

Frequently Asked Questions

What is the IUPAC name of N-[(3,5-difluorophenyl)-(4-methyl-3-pyridinyl)methyl]ethanamine?
The IUPAC name of N-[(3,5-difluorophenyl)-(4-methyl-3-pyridinyl)methyl]ethanamine (CID 66272491) is N-[(3,5-difluorophenyl)-(4-methyl-3-pyridinyl)methyl]ethanamine.
What is the SMILES notation for N-[(3,5-difluorophenyl)-(4-methyl-3-pyridinyl)methyl]ethanamine?
The canonical SMILES for N-[(3,5-difluorophenyl)-(4-methyl-3-pyridinyl)methyl]ethanamine is CCNC(c1cc(F)cc(F)c1)c1cnccc1C.
What is the InChIKey of N-[(3,5-difluorophenyl)-(4-methyl-3-pyridinyl)methyl]ethanamine?
The InChIKey is UHHNCLPNYVGBSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16F2N2/c1-3-19-15(14-9-18-5-4-10(14)2)11-6-12(16)8-13(17)7-11/h4-9,15,19H,3H2,1-2H3.
What are the key properties of N-[(3,5-difluorophenyl)-(4-methyl-3-pyridinyl)methyl]ethanamine?
N-[(3,5-difluorophenyl)-(4-methyl-3-pyridinyl)methyl]ethanamine has a molecular weight of 262.30 g/mol, XLogP of 3.37, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3,5-difluorophenyl)-(4-methyl-3-pyridinyl)methyl]ethanamine is sourced from PubChem (CID 66272491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).