[2-(3,5-difluorophenyl)-3-pyridinyl]methanamine

C12H10F2N2 — CID 110282116

IUPAC[2-(3,5-difluorophenyl)-3-pyridinyl]methanamine
SMILESNCc1cccnc1-c1cc(F)cc(F)c1
InChIInChI=1S/C12H10F2N2/c13-10-4-9(5-11(14)6-10)12-8(7-15)2-1-3-16-12/h1-6H,7,15H2
InChIKeyDMTBUXBEUPIGLR-UHFFFAOYSA-N
MW220.22 g/mol
LogP2.49
Rot. Bonds2

About [2-(3,5-difluorophenyl)-3-pyridinyl]methanamine

[2-(3,5-difluorophenyl)-3-pyridinyl]methanamine (PubChem CID 110282116) has the molecular formula C12H10F2N2 and a molecular weight of 220.22 g/mol. Its IUPAC name is [2-(3,5-difluorophenyl)-3-pyridinyl]methanamine.

Molecular Properties

Compound Name[2-(3,5-difluorophenyl)-3-pyridinyl]methanamine
PubChem CID110282116
Molecular FormulaC12H10F2N2
Molecular Weight220.22 g/mol
Exact Mass220.08
IUPAC Name[2-(3,5-difluorophenyl)-3-pyridinyl]methanamine
SMILESNCc1cccnc1-c1cc(F)cc(F)c1
InChIInChI=1S/C12H10F2N2/c13-10-4-9(5-11(14)6-10)12-8(7-15)2-1-3-16-12/h1-6H,7,15H2
InChIKeyDMTBUXBEUPIGLR-UHFFFAOYSA-N
XLogP2.49
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.22
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2-pyridin-3-yl-3-pyridinyl)methanamine
CID 19005903
[2-(3,4-dimethylphenyl)-3-pyridinyl]methanamine
CID 82508499
[2-[4-(trifluoromethyl)phenyl]-3-pyridinyl]methanamine;hydrochloride
CID 154904675
[4-[3-(aminomethyl)-2-pyridinyl]phenyl]methanol
CID 110282157
[2-(3-methoxyphenyl)-3-pyridinyl]methanamine
CID 82508828
[2-(4-fluorophenyl)-3-pyridinyl]methanol
CID 22158045
2-[2-(3-fluorophenyl)-3-pyridinyl]acetic acid
CID 117001575
[2-(4-propan-2-yloxyphenyl)-3-pyridinyl]methanamine
CID 117001852
2-[2-(3-fluorophenyl)-3-pyridinyl]acetonitrile
CID 117001885
[2-(3-phenylmethoxyphenyl)-3-pyridinyl]methanamine
CID 22663707
(1S)-1-[4-[3-(aminomethyl)-2-pyridinyl]phenyl]-N,N-dimethylethanamine
CID 126448583
2-[5-[3-(aminomethyl)-2-pyridinyl]-2-pyridinyl]propan-2-ol
CID 175948471

Frequently Asked Questions

What is the IUPAC name of [2-(3,5-difluorophenyl)-3-pyridinyl]methanamine?
The IUPAC name of [2-(3,5-difluorophenyl)-3-pyridinyl]methanamine (CID 110282116) is [2-(3,5-difluorophenyl)-3-pyridinyl]methanamine.
What is the SMILES notation for [2-(3,5-difluorophenyl)-3-pyridinyl]methanamine?
The canonical SMILES for [2-(3,5-difluorophenyl)-3-pyridinyl]methanamine is NCc1cccnc1-c1cc(F)cc(F)c1.
What is the InChIKey of [2-(3,5-difluorophenyl)-3-pyridinyl]methanamine?
The InChIKey is DMTBUXBEUPIGLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10F2N2/c13-10-4-9(5-11(14)6-10)12-8(7-15)2-1-3-16-12/h1-6H,7,15H2.
What are the key properties of [2-(3,5-difluorophenyl)-3-pyridinyl]methanamine?
[2-(3,5-difluorophenyl)-3-pyridinyl]methanamine has a molecular weight of 220.22 g/mol, XLogP of 2.49, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3,5-difluorophenyl)-3-pyridinyl]methanamine is sourced from PubChem (CID 110282116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).