1-(4-fluoro-3,5-dimethylphenyl)-2,3-dihydroimidazo[4,5-b]pyridine

C14H14FN3 — CID 164884576

IUPAC1-(4-fluoro-3,5-dimethylphenyl)-2,3-dihydroimidazo[4,5-b]pyridine
SMILESCc1cc(N2CNc3ncccc32)cc(C)c1F
InChIInChI=1S/C14H14FN3/c1-9-6-11(7-10(2)13(9)15)18-8-17-14-12(18)4-3-5-16-14/h3-7H,8H2,1-2H3,(H,16,17)
InChIKeyUATQHUMXFWQWTA-UHFFFAOYSA-N
MW243.28 g/mol
LogP3.36
Rot. Bonds1

About 1-(4-fluoro-3,5-dimethylphenyl)-2,3-dihydroimidazo[4,5-b]pyridine

1-(4-fluoro-3,5-dimethylphenyl)-2,3-dihydroimidazo[4,5-b]pyridine (PubChem CID 164884576) has the molecular formula C14H14FN3 and a molecular weight of 243.28 g/mol. Its IUPAC name is 1-(4-fluoro-3,5-dimethylphenyl)-2,3-dihydroimidazo[4,5-b]pyridine.

Molecular Properties

Compound Name1-(4-fluoro-3,5-dimethylphenyl)-2,3-dihydroimidazo[4,5-b]pyridine
PubChem CID164884576
Molecular FormulaC14H14FN3
Molecular Weight243.28 g/mol
Exact Mass243.12
IUPAC Name1-(4-fluoro-3,5-dimethylphenyl)-2,3-dihydroimidazo[4,5-b]pyridine
SMILESCc1cc(N2CNc3ncccc32)cc(C)c1F
InChIInChI=1S/C14H14FN3/c1-9-6-11(7-10(2)13(9)15)18-8-17-14-12(18)4-3-5-16-14/h3-7H,8H2,1-2H3,(H,16,17)
InChIKeyUATQHUMXFWQWTA-UHFFFAOYSA-N
XLogP3.36
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.28
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-phenyl-2,3-dihydroimidazo[4,5-b]pyridine
CID 139666855
2-[5-(2,3-dihydroimidazo[4,5-b]pyridin-1-yl)-1H-indol-3-yl]ethanamine
CID 54323492
1-[3-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-1H-indol-5-yl]-2,3-dihydroimidazo[4,5-b]pyridine
CID 54438250
1-[3-(pyrrolidin-2-ylmethyl)-1H-indol-5-yl]-2,3-dihydroimidazo[4,5-b]pyridine
CID 70068348
3-(3,5-difluorophenyl)-1-methyl-2H-imidazo[4,5-b]pyridine
CID 171052815
1-piperidin-4-yl-2,3-dihydroimidazo[4,5-b]pyridine
CID 58044714
1-bromo-3,4-dihydropyrido[2,3-b]pyrazin-2-one
CID 152678723
1-piperidin-4-yl-2,3-dihydroimidazo[4,5-b]pyridine;dihydrochloride
CID 173235933
1,3-bis(4-fluorophenyl)-2H-imidazo[4,5-b]pyridine
CID 140596008
3-propan-2-yl-2,4,5,8,10-pentazatricyclo[7.4.0.02,6]trideca-1(9),3,5,10,12-pentaene
CID 96611553
2-chloro-7-phenyl-8,9-dihydropurine
CID 178075727
1-iodo-3,4-dihydropyrido[2,3-b]pyrazin-2-one
CID 141188190

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluoro-3,5-dimethylphenyl)-2,3-dihydroimidazo[4,5-b]pyridine?
The IUPAC name of 1-(4-fluoro-3,5-dimethylphenyl)-2,3-dihydroimidazo[4,5-b]pyridine (CID 164884576) is 1-(4-fluoro-3,5-dimethylphenyl)-2,3-dihydroimidazo[4,5-b]pyridine.
What is the SMILES notation for 1-(4-fluoro-3,5-dimethylphenyl)-2,3-dihydroimidazo[4,5-b]pyridine?
The canonical SMILES for 1-(4-fluoro-3,5-dimethylphenyl)-2,3-dihydroimidazo[4,5-b]pyridine is Cc1cc(N2CNc3ncccc32)cc(C)c1F.
What is the InChIKey of 1-(4-fluoro-3,5-dimethylphenyl)-2,3-dihydroimidazo[4,5-b]pyridine?
The InChIKey is UATQHUMXFWQWTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FN3/c1-9-6-11(7-10(2)13(9)15)18-8-17-14-12(18)4-3-5-16-14/h3-7H,8H2,1-2H3,(H,16,17).
What are the key properties of 1-(4-fluoro-3,5-dimethylphenyl)-2,3-dihydroimidazo[4,5-b]pyridine?
1-(4-fluoro-3,5-dimethylphenyl)-2,3-dihydroimidazo[4,5-b]pyridine has a molecular weight of 243.28 g/mol, XLogP of 3.36, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluoro-3,5-dimethylphenyl)-2,3-dihydroimidazo[4,5-b]pyridine is sourced from PubChem (CID 164884576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).