7-[[2-methoxy-3-(trifluoromethyl)phenyl]methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine

C14H14F3N5O2 — CID 126678778

IUPAC7-[[2-methoxy-3-(trifluoromethyl)phenyl]methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine
SMILESCOc1c(COc2cc(N)nc3c2NNN3)cccc1C(F)(F)F
InChIInChI=1S/C14H14F3N5O2/c1-23-12-7(3-2-4-8(12)14(15,16)17)6-24-9-5-10(18)19-13-11(9)20-22-21-13/h2-5,20,22H,6H2,1H3,(H3,18,19,21)
InChIKeyKCOYNIATFUFXLS-UHFFFAOYSA-N
MW341.29 g/mol
LogP2.53
Rot. Bonds4

About 7-[[2-methoxy-3-(trifluoromethyl)phenyl]methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine

7-[[2-methoxy-3-(trifluoromethyl)phenyl]methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine (PubChem CID 126678778) has the molecular formula C14H14F3N5O2 and a molecular weight of 341.29 g/mol. Its IUPAC name is 7-[[2-methoxy-3-(trifluoromethyl)phenyl]methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine.

Molecular Properties

Compound Name7-[[2-methoxy-3-(trifluoromethyl)phenyl]methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine
PubChem CID126678778
Molecular FormulaC14H14F3N5O2
Molecular Weight341.29 g/mol
Exact Mass341.11
IUPAC Name7-[[2-methoxy-3-(trifluoromethyl)phenyl]methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine
SMILESCOc1c(COc2cc(N)nc3c2NNN3)cccc1C(F)(F)F
InChIInChI=1S/C14H14F3N5O2/c1-23-12-7(3-2-4-8(12)14(15,16)17)6-24-9-5-10(18)19-13-11(9)20-22-21-13/h2-5,20,22H,6H2,1H3,(H3,18,19,21)
InChIKeyKCOYNIATFUFXLS-UHFFFAOYSA-N
XLogP2.53
TPSA93.46 Ų
H-Bond Donors4
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.29
LogP ≤ 52.53
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 107

Analyze 7-[[2-methoxy-3-(trifluoromethyl)phenyl]methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine with MolForge

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Related Compounds

7-[[2-chloro-5-(trifluoromethyl)phenyl]methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine
CID 126679930
7-[[2-fluoro-5-(trifluoromethoxy)phenyl]methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine
CID 126680564
7-[[4-(3-methoxyphenyl)phenyl]methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine
CID 126679960
3-[2-methoxy-3-(trifluoromethyl)phenyl]-N,N-dimethylpropan-1-amine
CID 170865770
7-[[3-(1,2,4-triazol-1-yl)phenyl]methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine
CID 126678876
5-bromo-3-[(3-fluoro-2-methoxyphenyl)methoxy]pyridin-2-amine
CID 21111328
8-(trifluoromethyl)isoquinolin-3-amine
CID 71742569
1-[2-methoxy-3-(trifluoromethyl)phenyl]propan-2-ol
CID 117339947
1-[2-[2-methoxy-3-(trifluoromethyl)phenyl]ethyl]piperazine
CID 117465754
2-amino-3-[2-methoxy-3-(trifluoromethyl)phenyl]propanoic acid
CID 117411854
2-fluoro-5-(isoquinolin-8-ylmethoxy)-4-methoxyaniline
CID 166065965
5-(6-methoxyimidazo[1,2-a]pyridin-3-yl)-3-[[2-(trifluoromethyl)phenyl]methoxy]thiophene-2-carboxamide
CID 67436666

Frequently Asked Questions

What is the IUPAC name of 7-[[2-methoxy-3-(trifluoromethyl)phenyl]methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine?
The IUPAC name of 7-[[2-methoxy-3-(trifluoromethyl)phenyl]methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine (CID 126678778) is 7-[[2-methoxy-3-(trifluoromethyl)phenyl]methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine.
What is the SMILES notation for 7-[[2-methoxy-3-(trifluoromethyl)phenyl]methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine?
The canonical SMILES for 7-[[2-methoxy-3-(trifluoromethyl)phenyl]methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine is COc1c(COc2cc(N)nc3c2NNN3)cccc1C(F)(F)F.
What is the InChIKey of 7-[[2-methoxy-3-(trifluoromethyl)phenyl]methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine?
The InChIKey is KCOYNIATFUFXLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14F3N5O2/c1-23-12-7(3-2-4-8(12)14(15,16)17)6-24-9-5-10(18)19-13-11(9)20-22-21-13/h2-5,20,22H,6H2,1H3,(H3,18,19,21).
What are the key properties of 7-[[2-methoxy-3-(trifluoromethyl)phenyl]methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine?
7-[[2-methoxy-3-(trifluoromethyl)phenyl]methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine has a molecular weight of 341.29 g/mol, XLogP of 2.53, 4 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[[2-methoxy-3-(trifluoromethyl)phenyl]methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine is sourced from PubChem (CID 126678778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).