6-(furan-3-yl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine

C13H13F3N2O — CID 102716707

IUPAC6-(furan-3-yl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine
SMILESCCCNc1cc(C(F)(F)F)cc(-c2ccoc2)n1
InChIInChI=1S/C13H13F3N2O/c1-2-4-17-12-7-10(13(14,15)16)6-11(18-12)9-3-5-19-8-9/h3,5-8H,2,4H2,1H3,(H,17,18)
InChIKeyPTJKHMRDLXNKAP-UHFFFAOYSA-N
MW270.25 g/mol
LogP4.18
Rot. Bonds4

About 6-(furan-3-yl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine

6-(furan-3-yl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine (PubChem CID 102716707) has the molecular formula C13H13F3N2O and a molecular weight of 270.25 g/mol. Its IUPAC name is 6-(furan-3-yl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound Name6-(furan-3-yl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine
PubChem CID102716707
Molecular FormulaC13H13F3N2O
Molecular Weight270.25 g/mol
Exact Mass270.10
IUPAC Name6-(furan-3-yl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine
SMILESCCCNc1cc(C(F)(F)F)cc(-c2ccoc2)n1
InChIInChI=1S/C13H13F3N2O/c1-2-4-17-12-7-10(13(14,15)16)6-11(18-12)9-3-5-19-8-9/h3,5-8H,2,4H2,1H3,(H,17,18)
InChIKeyPTJKHMRDLXNKAP-UHFFFAOYSA-N
XLogP4.18
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.25
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-N-(furan-3-ylmethyl)-2-N-propyl-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102719417
6-(3-fluorophenyl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine
CID 102716586
6-(1-methylpyrazol-4-yl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine
CID 102716615
6-(2-ethylpyrazol-3-yl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine
CID 102716720
6-(2-methylthiophen-3-yl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine
CID 102838356
2-N-propyl-6-N-(2,2,2-trifluoroethyl)-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102717325
6-(3,4-dimethylphenyl)-N-ethyl-4-(trifluoromethyl)pyridin-2-amine
CID 102716647
6-imidazol-1-yl-N-propyl-4-(trifluoromethyl)pyridin-2-amine
CID 102719533
5-[[6-(propylamino)-4-(trifluoromethyl)-2-pyridinyl]amino]pentan-1-ol
CID 107324249
6-phenyl-N-propyl-2-(trifluoromethyl)pyrimidin-4-amine
CID 106769168
N-propyl-6-(2,2,2-trifluoroethoxy)-4-(trifluoromethyl)pyridin-2-amine
CID 102719676
6-N-(2-methylbutyl)-2-N-propyl-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102718352

Frequently Asked Questions

What is the IUPAC name of 6-(furan-3-yl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of 6-(furan-3-yl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine (CID 102716707) is 6-(furan-3-yl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for 6-(furan-3-yl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for 6-(furan-3-yl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine is CCCNc1cc(C(F)(F)F)cc(-c2ccoc2)n1.
What is the InChIKey of 6-(furan-3-yl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine?
The InChIKey is PTJKHMRDLXNKAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13F3N2O/c1-2-4-17-12-7-10(13(14,15)16)6-11(18-12)9-3-5-19-8-9/h3,5-8H,2,4H2,1H3,(H,17,18).
What are the key properties of 6-(furan-3-yl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine?
6-(furan-3-yl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine has a molecular weight of 270.25 g/mol, XLogP of 4.18, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(furan-3-yl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 102716707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).