[2-(furan-2-ylmethoxy)-6-(trifluoromethyl)-3-pyridinyl]methanamine

C12H11F3N2O2 — CID 79869669

IUPAC[2-(furan-2-ylmethoxy)-6-(trifluoromethyl)-3-pyridinyl]methanamine
SMILESNCc1ccc(C(F)(F)F)nc1OCc1ccco1
InChIInChI=1S/C12H11F3N2O2/c13-12(14,15)10-4-3-8(6-16)11(17-10)19-7-9-2-1-5-18-9/h1-5H,6-7,16H2
InChIKeyRSCGLQSWWIJUED-UHFFFAOYSA-N
MW272.23 g/mol
LogP2.73
Rot. Bonds4

About [2-(furan-2-ylmethoxy)-6-(trifluoromethyl)-3-pyridinyl]methanamine

[2-(furan-2-ylmethoxy)-6-(trifluoromethyl)-3-pyridinyl]methanamine (PubChem CID 79869669) has the molecular formula C12H11F3N2O2 and a molecular weight of 272.23 g/mol. Its IUPAC name is [2-(furan-2-ylmethoxy)-6-(trifluoromethyl)-3-pyridinyl]methanamine.

Molecular Properties

Compound Name[2-(furan-2-ylmethoxy)-6-(trifluoromethyl)-3-pyridinyl]methanamine
PubChem CID79869669
Molecular FormulaC12H11F3N2O2
Molecular Weight272.23 g/mol
Exact Mass272.08
IUPAC Name[2-(furan-2-ylmethoxy)-6-(trifluoromethyl)-3-pyridinyl]methanamine
SMILESNCc1ccc(C(F)(F)F)nc1OCc1ccco1
InChIInChI=1S/C12H11F3N2O2/c13-12(14,15)10-4-3-8(6-16)11(17-10)19-7-9-2-1-5-18-9/h1-5H,6-7,16H2
InChIKeyRSCGLQSWWIJUED-UHFFFAOYSA-N
XLogP2.73
TPSA61.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.23
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(furan-2-ylmethoxy)-6-(trifluoromethyl)pyridine-3-carbonitrile
CID 79869558
[2-(pyridin-4-ylmethoxy)-6-(trifluoromethyl)-3-pyridinyl]methanamine
CID 58873449
[2-[(4-tert-butylphenyl)methoxy]-6-(trifluoromethyl)-3-pyridinyl]methanamine
CID 58873264
acetic acid;[2-ethoxy-6-(trifluoromethyl)-3-pyridinyl]methanamine
CID 171929343
[2-(4-methoxyphenoxy)-6-(trifluoromethyl)-3-pyridinyl]methanamine
CID 79874080
[2-[2-(3-methoxypropoxy)ethoxy]-6-(trifluoromethyl)-3-pyridinyl]methanamine
CID 103176685
N-[2-[[3-(aminomethyl)-6-(trifluoromethyl)-2-pyridinyl]oxy]ethyl]-N-methylcyclopropanamine
CID 102739699
3,5-dichloro-6-(furan-2-ylmethoxy)pyridin-2-amine
CID 102760408
[2-propan-2-yl-6-(trifluoromethyl)-3-pyridinyl]methanamine
CID 119054456
[2-(3-chlorophenoxy)-6-(trifluoromethyl)-3-pyridinyl]methanamine
CID 79869812
2-[[3-(trifluoromethyl)phenoxy]methyl]furan
CID 101055355
acetic acid;[2-(cyclopentylmethoxy)-6-(trifluoromethyl)-3-pyridinyl]methanamine
CID 171924494

Frequently Asked Questions

What is the IUPAC name of [2-(furan-2-ylmethoxy)-6-(trifluoromethyl)-3-pyridinyl]methanamine?
The IUPAC name of [2-(furan-2-ylmethoxy)-6-(trifluoromethyl)-3-pyridinyl]methanamine (CID 79869669) is [2-(furan-2-ylmethoxy)-6-(trifluoromethyl)-3-pyridinyl]methanamine.
What is the SMILES notation for [2-(furan-2-ylmethoxy)-6-(trifluoromethyl)-3-pyridinyl]methanamine?
The canonical SMILES for [2-(furan-2-ylmethoxy)-6-(trifluoromethyl)-3-pyridinyl]methanamine is NCc1ccc(C(F)(F)F)nc1OCc1ccco1.
What is the InChIKey of [2-(furan-2-ylmethoxy)-6-(trifluoromethyl)-3-pyridinyl]methanamine?
The InChIKey is RSCGLQSWWIJUED-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11F3N2O2/c13-12(14,15)10-4-3-8(6-16)11(17-10)19-7-9-2-1-5-18-9/h1-5H,6-7,16H2.
What are the key properties of [2-(furan-2-ylmethoxy)-6-(trifluoromethyl)-3-pyridinyl]methanamine?
[2-(furan-2-ylmethoxy)-6-(trifluoromethyl)-3-pyridinyl]methanamine has a molecular weight of 272.23 g/mol, XLogP of 2.73, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(furan-2-ylmethoxy)-6-(trifluoromethyl)-3-pyridinyl]methanamine is sourced from PubChem (CID 79869669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).