6-methyl-2-(2,2,2-trifluoroethoxymethyl)-1H-imidazo[4,5-b]pyridine

C10H10F3N3O — CID 103208878

IUPAC6-methyl-2-(2,2,2-trifluoroethoxymethyl)-1H-imidazo[4,5-b]pyridine
SMILESCc1cnc2nc(COCC(F)(F)F)[nH]c2c1
InChIInChI=1S/C10H10F3N3O/c1-6-2-7-9(14-3-6)16-8(15-7)4-17-5-10(11,12)13/h2-3H,4-5H2,1H3,(H,14,15,16)
InChIKeyXYPPIRCKHVRHMT-UHFFFAOYSA-N
MW245.20 g/mol
LogP2.35
Rot. Bonds3

About 6-methyl-2-(2,2,2-trifluoroethoxymethyl)-1H-imidazo[4,5-b]pyridine

6-methyl-2-(2,2,2-trifluoroethoxymethyl)-1H-imidazo[4,5-b]pyridine (PubChem CID 103208878) has the molecular formula C10H10F3N3O and a molecular weight of 245.20 g/mol. Its IUPAC name is 6-methyl-2-(2,2,2-trifluoroethoxymethyl)-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name6-methyl-2-(2,2,2-trifluoroethoxymethyl)-1H-imidazo[4,5-b]pyridine
PubChem CID103208878
Molecular FormulaC10H10F3N3O
Molecular Weight245.20 g/mol
Exact Mass245.08
IUPAC Name6-methyl-2-(2,2,2-trifluoroethoxymethyl)-1H-imidazo[4,5-b]pyridine
SMILESCc1cnc2nc(COCC(F)(F)F)[nH]c2c1
InChIInChI=1S/C10H10F3N3O/c1-6-2-7-9(14-3-6)16-8(15-7)4-17-5-10(11,12)13/h2-3H,4-5H2,1H3,(H,14,15,16)
InChIKeyXYPPIRCKHVRHMT-UHFFFAOYSA-N
XLogP2.35
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.20
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-bromo-2-(2,2,2-trifluoroethoxymethyl)-1H-imidazo[4,5-b]pyridine
CID 103208843
6-methyl-2-(3,3,3-trifluoropropyl)-1H-imidazo[4,5-b]pyridine
CID 79796392
6-methyl-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine
CID 79015215
5,6-dichloro-2-(2,2,2-trifluoroethoxymethyl)-1H-imidazo[4,5-b]pyridine
CID 103208916
4,6-difluoro-2-(2,2,2-trifluoroethoxymethyl)-1H-benzimidazole
CID 103208892
2-[(3-bromophenyl)methyl]-6-methyl-1H-imidazo[4,5-b]pyridine
CID 79795297
2-methoxy-3-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)propan-1-amine
CID 103154004
2-[(2-chloro-6-fluorophenyl)methyl]-6-methyl-1H-imidazo[4,5-b]pyridine
CID 79795368
N-[2-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)ethyl]aniline
CID 79795868
6-methyl-2-[2-(3-methylphenoxy)ethyl]-1H-imidazo[4,5-b]pyridine
CID 79795712
N-[(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)methyl]cyclopropanamine
CID 79795782
2-chloro-6-methyl-1H-imidazo[4,5-b]pyridine
CID 122362438

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-(2,2,2-trifluoroethoxymethyl)-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 6-methyl-2-(2,2,2-trifluoroethoxymethyl)-1H-imidazo[4,5-b]pyridine (CID 103208878) is 6-methyl-2-(2,2,2-trifluoroethoxymethyl)-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 6-methyl-2-(2,2,2-trifluoroethoxymethyl)-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 6-methyl-2-(2,2,2-trifluoroethoxymethyl)-1H-imidazo[4,5-b]pyridine is Cc1cnc2nc(COCC(F)(F)F)[nH]c2c1.
What is the InChIKey of 6-methyl-2-(2,2,2-trifluoroethoxymethyl)-1H-imidazo[4,5-b]pyridine?
The InChIKey is XYPPIRCKHVRHMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F3N3O/c1-6-2-7-9(14-3-6)16-8(15-7)4-17-5-10(11,12)13/h2-3H,4-5H2,1H3,(H,14,15,16).
What are the key properties of 6-methyl-2-(2,2,2-trifluoroethoxymethyl)-1H-imidazo[4,5-b]pyridine?
6-methyl-2-(2,2,2-trifluoroethoxymethyl)-1H-imidazo[4,5-b]pyridine has a molecular weight of 245.20 g/mol, XLogP of 2.35, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-(2,2,2-trifluoroethoxymethyl)-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 103208878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).