3-[(3R)-3-(4-fluorophenyl)oxolan-3-yl]-5-(3-methylimidazo[4,5-b]pyridin-6-yl)-1,2,4-oxadiazole

C19H16FN5O2 — CID 95218529

IUPAC3-[(3R)-3-(4-fluorophenyl)oxolan-3-yl]-5-(3-methylimidazo[4,5-b]pyridin-6-yl)-1,2,4-oxadiazole
SMILESCn1cnc2cc(-c3nc([C@]4(c5ccc(F)cc5)CCOC4)no3)cnc21
InChIInChI=1S/C19H16FN5O2/c1-25-11-22-15-8-12(9-21-16(15)25)17-23-18(24-27-17)19(6-7-26-10-19)13-2-4-14(20)5-3-13/h2-5,8-9,11H,6-7,10H2,1H3/t19-/m1/s1
InChIKeyWLYMMTGPKQOQPM-LJQANCHMSA-N
MW365.37 g/mol
LogP2.86
Rot. Bonds3

About 3-[(3R)-3-(4-fluorophenyl)oxolan-3-yl]-5-(3-methylimidazo[4,5-b]pyridin-6-yl)-1,2,4-oxadiazole

3-[(3R)-3-(4-fluorophenyl)oxolan-3-yl]-5-(3-methylimidazo[4,5-b]pyridin-6-yl)-1,2,4-oxadiazole (PubChem CID 95218529) has the molecular formula C19H16FN5O2 and a molecular weight of 365.37 g/mol. Its IUPAC name is 3-[(3R)-3-(4-fluorophenyl)oxolan-3-yl]-5-(3-methylimidazo[4,5-b]pyridin-6-yl)-1,2,4-oxadiazole.

Molecular Properties

Compound Name3-[(3R)-3-(4-fluorophenyl)oxolan-3-yl]-5-(3-methylimidazo[4,5-b]pyridin-6-yl)-1,2,4-oxadiazole
PubChem CID95218529
Molecular FormulaC19H16FN5O2
Molecular Weight365.37 g/mol
Exact Mass365.13
IUPAC Name3-[(3R)-3-(4-fluorophenyl)oxolan-3-yl]-5-(3-methylimidazo[4,5-b]pyridin-6-yl)-1,2,4-oxadiazole
SMILESCn1cnc2cc(-c3nc([C@]4(c5ccc(F)cc5)CCOC4)no3)cnc21
InChIInChI=1S/C19H16FN5O2/c1-25-11-22-15-8-12(9-21-16(15)25)17-23-18(24-27-17)19(6-7-26-10-19)13-2-4-14(20)5-3-13/h2-5,8-9,11H,6-7,10H2,1H3/t19-/m1/s1
InChIKeyWLYMMTGPKQOQPM-LJQANCHMSA-N
XLogP2.86
TPSA78.86 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.37
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

5-(3H-benzimidazol-5-yl)-3-[(3S)-3-(4-fluorophenyl)oxolan-3-yl]-1,2,4-oxadiazole
CID 95215992
3-[3-[(3R)-3-(4-fluorophenyl)oxolan-3-yl]-1,2,4-oxadiazol-5-yl]-1,4,6-trimethylpyridin-2-one
CID 95204467
3-[(3R)-3-(4-fluorophenyl)oxolan-3-yl]-5-(1H-indazol-3-yl)-1,2,4-oxadiazole
CID 29022096
1-[3-[3-(4-fluorophenyl)oxolan-3-yl]-1,2,4-oxadiazol-5-yl]cyclopentan-1-amine
CID 56712323
N-[[3-[3-(4-fluorophenyl)oxolan-3-yl]-1,2,4-oxadiazol-5-yl]methyl]acetamide
CID 45190975
3-[3-(4-fluorophenyl)oxolan-3-yl]-5-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1,2,4-oxadiazole
CID 56717288
1-[[3-[(3S)-3-(4-fluorophenyl)oxolan-3-yl]-1,2,4-oxadiazol-5-yl]methyl]azepan-2-one
CID 95212564
5-[4-(4-fluorophenyl)oxan-4-yl]-1-methyl-1,2,4-triazole
CID 72881228
N-[[4-(3-fluorophenyl)oxan-4-yl]methyl]-3-methylimidazo[4,5-b]pyridine-6-carboxamide
CID 176502841
5-(4-fluorophenyl)-3-(2-methylpiperidin-2-yl)-1,2,4-oxadiazole
CID 172908876
5-[3-bromo-4-methyl-1-(2-methylsulfanylethyl)pyrazol-5-yl]-3-[1-(2-chloro-4-fluorophenyl)cyclopropyl]-1,2,4-oxadiazole
CID 177007218
3-[3-(4-methoxyoxan-4-yl)-1,2,4-oxadiazol-5-yl]quinolin-7-ol
CID 146142994

Frequently Asked Questions

What is the IUPAC name of 3-[(3R)-3-(4-fluorophenyl)oxolan-3-yl]-5-(3-methylimidazo[4,5-b]pyridin-6-yl)-1,2,4-oxadiazole?
The IUPAC name of 3-[(3R)-3-(4-fluorophenyl)oxolan-3-yl]-5-(3-methylimidazo[4,5-b]pyridin-6-yl)-1,2,4-oxadiazole (CID 95218529) is 3-[(3R)-3-(4-fluorophenyl)oxolan-3-yl]-5-(3-methylimidazo[4,5-b]pyridin-6-yl)-1,2,4-oxadiazole.
What is the SMILES notation for 3-[(3R)-3-(4-fluorophenyl)oxolan-3-yl]-5-(3-methylimidazo[4,5-b]pyridin-6-yl)-1,2,4-oxadiazole?
The canonical SMILES for 3-[(3R)-3-(4-fluorophenyl)oxolan-3-yl]-5-(3-methylimidazo[4,5-b]pyridin-6-yl)-1,2,4-oxadiazole is Cn1cnc2cc(-c3nc([C@]4(c5ccc(F)cc5)CCOC4)no3)cnc21.
What is the InChIKey of 3-[(3R)-3-(4-fluorophenyl)oxolan-3-yl]-5-(3-methylimidazo[4,5-b]pyridin-6-yl)-1,2,4-oxadiazole?
The InChIKey is WLYMMTGPKQOQPM-LJQANCHMSA-N. The full InChI is InChI=1S/C19H16FN5O2/c1-25-11-22-15-8-12(9-21-16(15)25)17-23-18(24-27-17)19(6-7-26-10-19)13-2-4-14(20)5-3-13/h2-5,8-9,11H,6-7,10H2,1H3/t19-/m1/s1.
What are the key properties of 3-[(3R)-3-(4-fluorophenyl)oxolan-3-yl]-5-(3-methylimidazo[4,5-b]pyridin-6-yl)-1,2,4-oxadiazole?
3-[(3R)-3-(4-fluorophenyl)oxolan-3-yl]-5-(3-methylimidazo[4,5-b]pyridin-6-yl)-1,2,4-oxadiazole has a molecular weight of 365.37 g/mol, XLogP of 2.86, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3R)-3-(4-fluorophenyl)oxolan-3-yl]-5-(3-methylimidazo[4,5-b]pyridin-6-yl)-1,2,4-oxadiazole is sourced from PubChem (CID 95218529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).