3,5-dimethyl-4-[6-(2-phenoxyphenyl)imidazo[1,5-a]pyridin-8-yl]-1,2-oxazole

C24H19N3O2 — CID 134809343

IUPAC3,5-dimethyl-4-[6-(2-phenoxyphenyl)imidazo[1,5-a]pyridin-8-yl]-1,2-oxazole
SMILESCc1noc(C)c1-c1cc(-c2ccccc2Oc2ccccc2)cn2cncc12
InChIInChI=1S/C24H19N3O2/c1-16-24(17(2)29-26-16)21-12-18(14-27-15-25-13-22(21)27)20-10-6-7-11-23(20)28-19-8-4-3-5-9-19/h3-15H,1-2H3
InChIKeyZAPLJRUMVFHDCW-UHFFFAOYSA-N
MW381.44 g/mol
LogP6.07
Rot. Bonds4

About 3,5-dimethyl-4-[6-(2-phenoxyphenyl)imidazo[1,5-a]pyridin-8-yl]-1,2-oxazole

3,5-dimethyl-4-[6-(2-phenoxyphenyl)imidazo[1,5-a]pyridin-8-yl]-1,2-oxazole (PubChem CID 134809343) has the molecular formula C24H19N3O2 and a molecular weight of 381.44 g/mol. Its IUPAC name is 3,5-dimethyl-4-[6-(2-phenoxyphenyl)imidazo[1,5-a]pyridin-8-yl]-1,2-oxazole.

Molecular Properties

Compound Name3,5-dimethyl-4-[6-(2-phenoxyphenyl)imidazo[1,5-a]pyridin-8-yl]-1,2-oxazole
PubChem CID134809343
Molecular FormulaC24H19N3O2
Molecular Weight381.44 g/mol
Exact Mass381.15
IUPAC Name3,5-dimethyl-4-[6-(2-phenoxyphenyl)imidazo[1,5-a]pyridin-8-yl]-1,2-oxazole
SMILESCc1noc(C)c1-c1cc(-c2ccccc2Oc2ccccc2)cn2cncc12
InChIInChI=1S/C24H19N3O2/c1-16-24(17(2)29-26-16)21-12-18(14-27-15-25-13-22(21)27)20-10-6-7-11-23(20)28-19-8-4-3-5-9-19/h3-15H,1-2H3
InChIKeyZAPLJRUMVFHDCW-UHFFFAOYSA-N
XLogP6.07
TPSA52.56 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500381.44
LogP ≤ 56.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

PF-Cbp1
CID 119081417
N-(3-{[2-(4-amino-1,2,5-oxadiazol-3-yl)-1-ethyl-1H-imidazo[4,5-c]pyridin-6-yl]oxy}phenyl)benzamide
CID 11339681
1-(3-{[2-(4-Amino-furazan-3-yl)-1-ethyl-1H-imidazo[4,5-c]pyridin-6-yl]oxy}phenyl)ethanone
CID 11772907
5-(3,5-Dimethyl-1,2-Oxazol-4-Yl)-2-[2-(4-Methoxyphenyl)ethyl]-1-[2-(Morpholin-4-Yl)ethyl]-1h-Benzimidazole
CID 121237855
3-(4-(2-(5-(3,5-Dimethyl-4-isoxazolyl)-1-(2-(4-morpholinyl)ethyl)-1H-benzimidazol-2-yl)ethyl)phenoxy)-N,N-dimethyl-1-propanamine
CID 121237857
8-Oxa-14,21,23,28-tetraazapentacyclo[23.3.1.02,7.014,22.015,20]nonacosa-1(28),2(7),3,5,15,17,19,21,25(29),26-decaen-24-one
CID 139593670
4-[2-[5-(3,5-Dimethyl-1,2-oxazol-4-yl)-2-[2-(4-ethoxyphenyl)ethyl]benzimidazol-1-yl]ethyl]morpholine
CID 137319664
4-Methoxy-3-[4-(2-methyl-imidazo[4,5-c]pyridin-1-ylmethyl)-benzoyl]-indole-1-carboxylic acid dimethylamide
CID 10790411
Dimethyl-carbamic acid 1-dimethylcarbamoyl-3-[4-(2-methyl-imidazo[4,5-c]pyridin-1-ylmethyl)-benzoyl]-1H-indol-4-yl ester
CID 11800214
N-(2,6-dimethylbenzyl)-6-(furan-2-yl)-2,3-dimethylimidazo[1,2-a]pyridin-8-amine
CID 24890348
7-(3,5-dimethyl-4-isoxazolyl)-8-(methoxy)-1-(2-pyridinylmethyl)-2-(tetrahydro-2H-pyran-4-yl)-1H-imidazo[4,5-c]quinoline
CID 52934042
7-[(1S)-1-(4-fluorophenyl)ethyl]-3-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]-5,6-dihydro-4H-[1,2]oxazolo[5,4-b]pyridine
CID 53316729

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-4-[6-(2-phenoxyphenyl)imidazo[1,5-a]pyridin-8-yl]-1,2-oxazole?
The IUPAC name of 3,5-dimethyl-4-[6-(2-phenoxyphenyl)imidazo[1,5-a]pyridin-8-yl]-1,2-oxazole (CID 134809343) is 3,5-dimethyl-4-[6-(2-phenoxyphenyl)imidazo[1,5-a]pyridin-8-yl]-1,2-oxazole.
What is the SMILES notation for 3,5-dimethyl-4-[6-(2-phenoxyphenyl)imidazo[1,5-a]pyridin-8-yl]-1,2-oxazole?
The canonical SMILES for 3,5-dimethyl-4-[6-(2-phenoxyphenyl)imidazo[1,5-a]pyridin-8-yl]-1,2-oxazole is Cc1noc(C)c1-c1cc(-c2ccccc2Oc2ccccc2)cn2cncc12.
What is the InChIKey of 3,5-dimethyl-4-[6-(2-phenoxyphenyl)imidazo[1,5-a]pyridin-8-yl]-1,2-oxazole?
The InChIKey is ZAPLJRUMVFHDCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19N3O2/c1-16-24(17(2)29-26-16)21-12-18(14-27-15-25-13-22(21)27)20-10-6-7-11-23(20)28-19-8-4-3-5-9-19/h3-15H,1-2H3.
What are the key properties of 3,5-dimethyl-4-[6-(2-phenoxyphenyl)imidazo[1,5-a]pyridin-8-yl]-1,2-oxazole?
3,5-dimethyl-4-[6-(2-phenoxyphenyl)imidazo[1,5-a]pyridin-8-yl]-1,2-oxazole has a molecular weight of 381.44 g/mol, XLogP of 6.07, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-4-[6-(2-phenoxyphenyl)imidazo[1,5-a]pyridin-8-yl]-1,2-oxazole is sourced from PubChem (CID 134809343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).