7-[4-(trifluoromethyl)phenoxy]-3,4-dihydro-2H-pyrano[2,3-b]pyridin-4-amine

C15H13F3N2O2 — CID 142503947

IUPAC7-[4-(trifluoromethyl)phenoxy]-3,4-dihydro-2H-pyrano[2,3-b]pyridin-4-amine
SMILESNC1CCOc2nc(Oc3ccc(C(F)(F)F)cc3)ccc21
InChIInChI=1S/C15H13F3N2O2/c16-15(17,18)9-1-3-10(4-2-9)22-13-6-5-11-12(19)7-8-21-14(11)20-13/h1-6,12H,7-8,19H2
InChIKeyLZTOZVMWEDGFJU-UHFFFAOYSA-N
MW310.28 g/mol
LogP3.67
Rot. Bonds2

About 7-[4-(trifluoromethyl)phenoxy]-3,4-dihydro-2H-pyrano[2,3-b]pyridin-4-amine

7-[4-(trifluoromethyl)phenoxy]-3,4-dihydro-2H-pyrano[2,3-b]pyridin-4-amine (PubChem CID 142503947) has the molecular formula C15H13F3N2O2 and a molecular weight of 310.28 g/mol. Its IUPAC name is 7-[4-(trifluoromethyl)phenoxy]-3,4-dihydro-2H-pyrano[2,3-b]pyridin-4-amine.

Molecular Properties

Compound Name7-[4-(trifluoromethyl)phenoxy]-3,4-dihydro-2H-pyrano[2,3-b]pyridin-4-amine
PubChem CID142503947
Molecular FormulaC15H13F3N2O2
Molecular Weight310.28 g/mol
Exact Mass310.09
IUPAC Name7-[4-(trifluoromethyl)phenoxy]-3,4-dihydro-2H-pyrano[2,3-b]pyridin-4-amine
SMILESNC1CCOc2nc(Oc3ccc(C(F)(F)F)cc3)ccc21
InChIInChI=1S/C15H13F3N2O2/c16-15(17,18)9-1-3-10(4-2-9)22-13-6-5-11-12(19)7-8-21-14(11)20-13/h1-6,12H,7-8,19H2
InChIKeyLZTOZVMWEDGFJU-UHFFFAOYSA-N
XLogP3.67
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.28
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

8-[4-(trifluoromethyl)phenoxy]-3,4-dihydro-2H-chromen-4-amine
CID 135373989
8-[4-(trifluoromethyl)phenoxy]-2,3,4,5-tetrahydro-1-benzoxepin-5-amine
CID 142503918
(4R)-8-(trifluoromethyl)-3,4-dihydro-2H-chromen-4-amine
CID 46911909
3-amino-6-[4-(trifluoromethyl)phenoxy]pyridine-2-carbonitrile
CID 103469607
6-(4-chlorophenoxy)-3-cyclopropyl-2-(trifluoromethyl)pyridine
CID 174975457
[6-[4-(trifluoromethyl)phenoxy]pyrimidin-4-yl]hydrazine
CID 80918117
(4S)-8-(trifluoromethoxy)-3,4-dihydro-2H-chromen-4-amine
CID 124518459
6-[4-(trifluoromethyl)phenoxy]pyrimidin-4-amine
CID 80862607
2,4-dimethyl-6-[4-(trifluoromethyl)phenoxy]pyrimidine
CID 176691058
(4R)-6-(trifluoromethoxy)-3,4-dihydro-2H-chromen-4-amine;hydrochloride
CID 91844836
3-chloro-6-[4-(trifluoromethyl)phenoxy]pyridine-2-carboxylic acid
CID 29080706
2-amino-5-[4-(trifluoromethyl)phenoxy]cyclopentan-1-ol
CID 19850274

Frequently Asked Questions

What is the IUPAC name of 7-[4-(trifluoromethyl)phenoxy]-3,4-dihydro-2H-pyrano[2,3-b]pyridin-4-amine?
The IUPAC name of 7-[4-(trifluoromethyl)phenoxy]-3,4-dihydro-2H-pyrano[2,3-b]pyridin-4-amine (CID 142503947) is 7-[4-(trifluoromethyl)phenoxy]-3,4-dihydro-2H-pyrano[2,3-b]pyridin-4-amine.
What is the SMILES notation for 7-[4-(trifluoromethyl)phenoxy]-3,4-dihydro-2H-pyrano[2,3-b]pyridin-4-amine?
The canonical SMILES for 7-[4-(trifluoromethyl)phenoxy]-3,4-dihydro-2H-pyrano[2,3-b]pyridin-4-amine is NC1CCOc2nc(Oc3ccc(C(F)(F)F)cc3)ccc21.
What is the InChIKey of 7-[4-(trifluoromethyl)phenoxy]-3,4-dihydro-2H-pyrano[2,3-b]pyridin-4-amine?
The InChIKey is LZTOZVMWEDGFJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F3N2O2/c16-15(17,18)9-1-3-10(4-2-9)22-13-6-5-11-12(19)7-8-21-14(11)20-13/h1-6,12H,7-8,19H2.
What are the key properties of 7-[4-(trifluoromethyl)phenoxy]-3,4-dihydro-2H-pyrano[2,3-b]pyridin-4-amine?
7-[4-(trifluoromethyl)phenoxy]-3,4-dihydro-2H-pyrano[2,3-b]pyridin-4-amine has a molecular weight of 310.28 g/mol, XLogP of 3.67, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[4-(trifluoromethyl)phenoxy]-3,4-dihydro-2H-pyrano[2,3-b]pyridin-4-amine is sourced from PubChem (CID 142503947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).