4-[2-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-indol-3-yl]phenol

C19H16N2O2 — CID 10425133

IUPAC4-[2-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-indol-3-yl]phenol
SMILESCc1noc(C)c1-c1[nH]c2ccccc2c1-c1ccc(O)cc1
InChIInChI=1S/C19H16N2O2/c1-11-17(12(2)23-21-11)19-18(13-7-9-14(22)10-8-13)15-5-3-4-6-16(15)20-19/h3-10,20,22H,1-2H3
InChIKeyJOIQPSICRVAXSP-UHFFFAOYSA-N
MW304.35 g/mol
LogP4.81
Rot. Bonds2

About 4-[2-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-indol-3-yl]phenol

4-[2-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-indol-3-yl]phenol (PubChem CID 10425133) has the molecular formula C19H16N2O2 and a molecular weight of 304.35 g/mol. Its IUPAC name is 4-[2-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-indol-3-yl]phenol.

Molecular Properties

Compound Name4-[2-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-indol-3-yl]phenol
PubChem CID10425133
Molecular FormulaC19H16N2O2
Molecular Weight304.35 g/mol
Exact Mass304.12
IUPAC Name4-[2-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-indol-3-yl]phenol
SMILESCc1noc(C)c1-c1[nH]c2ccccc2c1-c1ccc(O)cc1
InChIInChI=1S/C19H16N2O2/c1-11-17(12(2)23-21-11)19-18(13-7-9-14(22)10-8-13)15-5-3-4-6-16(15)20-19/h3-10,20,22H,1-2H3
InChIKeyJOIQPSICRVAXSP-UHFFFAOYSA-N
XLogP4.81
TPSA62.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 54.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[2-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-indol-3-yl]phenol?
The IUPAC name of 4-[2-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-indol-3-yl]phenol (CID 10425133) is 4-[2-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-indol-3-yl]phenol.
What is the SMILES notation for 4-[2-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-indol-3-yl]phenol?
The canonical SMILES for 4-[2-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-indol-3-yl]phenol is Cc1noc(C)c1-c1[nH]c2ccccc2c1-c1ccc(O)cc1.
What is the InChIKey of 4-[2-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-indol-3-yl]phenol?
The InChIKey is JOIQPSICRVAXSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O2/c1-11-17(12(2)23-21-11)19-18(13-7-9-14(22)10-8-13)15-5-3-4-6-16(15)20-19/h3-10,20,22H,1-2H3.
What are the key properties of 4-[2-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-indol-3-yl]phenol?
4-[2-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-indol-3-yl]phenol has a molecular weight of 304.35 g/mol, XLogP of 4.81, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-indol-3-yl]phenol is sourced from PubChem (CID 10425133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).