7-[(2-chloro-6-fluorophenyl)methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine

C12H11ClFN5O — CID 126678884

IUPAC7-[(2-chloro-6-fluorophenyl)methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine
SMILESNc1cc(OCc2c(F)cccc2Cl)c2c(n1)NNN2
InChIInChI=1S/C12H11ClFN5O/c13-7-2-1-3-8(14)6(7)5-20-9-4-10(15)16-12-11(9)17-19-18-12/h1-4,17,19H,5H2,(H3,15,16,18)
InChIKeyOLZXRSLDROIABP-UHFFFAOYSA-N
MW295.70 g/mol
LogP2.29
Rot. Bonds3

About 7-[(2-chloro-6-fluorophenyl)methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine

7-[(2-chloro-6-fluorophenyl)methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine (PubChem CID 126678884) has the molecular formula C12H11ClFN5O and a molecular weight of 295.70 g/mol. Its IUPAC name is 7-[(2-chloro-6-fluorophenyl)methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine.

Molecular Properties

Compound Name7-[(2-chloro-6-fluorophenyl)methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine
PubChem CID126678884
Molecular FormulaC12H11ClFN5O
Molecular Weight295.70 g/mol
Exact Mass295.06
IUPAC Name7-[(2-chloro-6-fluorophenyl)methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine
SMILESNc1cc(OCc2c(F)cccc2Cl)c2c(n1)NNN2
InChIInChI=1S/C12H11ClFN5O/c13-7-2-1-3-8(14)6(7)5-20-9-4-10(15)16-12-11(9)17-19-18-12/h1-4,17,19H,5H2,(H3,15,16,18)
InChIKeyOLZXRSLDROIABP-UHFFFAOYSA-N
XLogP2.29
TPSA84.23 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.70
LogP ≤ 52.29
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Analyze 7-[(2-chloro-6-fluorophenyl)methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine with MolForge

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Related Compounds

7-((4-chlorobenzyl)oxy)-3H-[1,2,3]triazolo[4,5-b]pyridin-5-amine
CID 126678883
7-[(2,6-dichlorophenyl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 126678975
7-((3-chlorobenzyl)oxy)-3H-[1,2,3]triazolo[4,5-b]pyridin-5-amine
CID 126680348
7-[(2-chlorophenyl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 126680363
7-[(2-chloro-6-fluorophenyl)methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 126648728
7-[[2-chloro-5-(trifluoromethyl)phenyl]methoxy]-2H-triazolo[4,5-b]pyridin-5-amine
CID 126648819
3-[(4-Chlorophenyl)diazenyl]-4-(2,2,2-trifluoro-1-phenylethoxy)pyridine-2,6-diamine
CID 126649083
4-[(2,6-Difluorophenyl)methoxy]-6-hydrazinylpyridine-2,5-diamine
CID 126678665
7-[[2-methoxy-3-(trifluoromethyl)phenyl]methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine
CID 126678778
7-[[4-(difluoromethoxy)phenyl]methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine
CID 126678796
4-[[4-(Difluoromethoxy)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine
CID 126678797
4-[[3-(3-Fluorophenyl)phenyl]methoxy]-6-hydrazinylpyridine-2,5-diamine
CID 126678820

Frequently Asked Questions

What is the IUPAC name of 7-[(2-chloro-6-fluorophenyl)methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine?
The IUPAC name of 7-[(2-chloro-6-fluorophenyl)methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine (CID 126678884) is 7-[(2-chloro-6-fluorophenyl)methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine.
What is the SMILES notation for 7-[(2-chloro-6-fluorophenyl)methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine?
The canonical SMILES for 7-[(2-chloro-6-fluorophenyl)methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine is Nc1cc(OCc2c(F)cccc2Cl)c2c(n1)NNN2.
What is the InChIKey of 7-[(2-chloro-6-fluorophenyl)methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine?
The InChIKey is OLZXRSLDROIABP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11ClFN5O/c13-7-2-1-3-8(14)6(7)5-20-9-4-10(15)16-12-11(9)17-19-18-12/h1-4,17,19H,5H2,(H3,15,16,18).
What are the key properties of 7-[(2-chloro-6-fluorophenyl)methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine?
7-[(2-chloro-6-fluorophenyl)methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine has a molecular weight of 295.70 g/mol, XLogP of 2.29, 3 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(2-chloro-6-fluorophenyl)methoxy]-2,3-dihydro-1H-triazolo[4,5-b]pyridin-5-amine is sourced from PubChem (CID 126678884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).