4-(2,2-dimethyl-4-phenyl-5H-1,3-oxazol-5-yl)-N,N-dimethylaniline

C19H22N2O — CID 3061433

IUPAC4-(2,2-dimethyl-4-phenyl-5H-1,3-oxazol-5-yl)-N,N-dimethylaniline
SMILESCN(C)c1ccc(C2OC(C)(C)N=C2c2ccccc2)cc1
InChIInChI=1S/C19H22N2O/c1-19(2)20-17(14-8-6-5-7-9-14)18(22-19)15-10-12-16(13-11-15)21(3)4/h5-13,18H,1-4H3
InChIKeyDGYJMGYWUWKAQI-UHFFFAOYSA-N
MW294.40 g/mol
LogP4.05
Rot. Bonds3

About 4-(2,2-dimethyl-4-phenyl-5H-1,3-oxazol-5-yl)-N,N-dimethylaniline

4-(2,2-dimethyl-4-phenyl-5H-1,3-oxazol-5-yl)-N,N-dimethylaniline (PubChem CID 3061433) has the molecular formula C19H22N2O and a molecular weight of 294.40 g/mol. Its IUPAC name is 4-(2,2-dimethyl-4-phenyl-5H-1,3-oxazol-5-yl)-N,N-dimethylaniline.

Molecular Properties

Compound Name4-(2,2-dimethyl-4-phenyl-5H-1,3-oxazol-5-yl)-N,N-dimethylaniline
PubChem CID3061433
Molecular FormulaC19H22N2O
Molecular Weight294.40 g/mol
Exact Mass294.17
IUPAC Name4-(2,2-dimethyl-4-phenyl-5H-1,3-oxazol-5-yl)-N,N-dimethylaniline
SMILESCN(C)c1ccc(C2OC(C)(C)N=C2c2ccccc2)cc1
InChIInChI=1S/C19H22N2O/c1-19(2)20-17(14-8-6-5-7-9-14)18(22-19)15-10-12-16(13-11-15)21(3)4/h5-13,18H,1-4H3
InChIKeyDGYJMGYWUWKAQI-UHFFFAOYSA-N
XLogP4.05
TPSA24.83 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(2,2-dimethyl-4-phenyl-5H-1,3-oxazol-5-yl)-N,N-dimethylaniline?
The IUPAC name of 4-(2,2-dimethyl-4-phenyl-5H-1,3-oxazol-5-yl)-N,N-dimethylaniline (CID 3061433) is 4-(2,2-dimethyl-4-phenyl-5H-1,3-oxazol-5-yl)-N,N-dimethylaniline.
What is the SMILES notation for 4-(2,2-dimethyl-4-phenyl-5H-1,3-oxazol-5-yl)-N,N-dimethylaniline?
The canonical SMILES for 4-(2,2-dimethyl-4-phenyl-5H-1,3-oxazol-5-yl)-N,N-dimethylaniline is CN(C)c1ccc(C2OC(C)(C)N=C2c2ccccc2)cc1.
What is the InChIKey of 4-(2,2-dimethyl-4-phenyl-5H-1,3-oxazol-5-yl)-N,N-dimethylaniline?
The InChIKey is DGYJMGYWUWKAQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O/c1-19(2)20-17(14-8-6-5-7-9-14)18(22-19)15-10-12-16(13-11-15)21(3)4/h5-13,18H,1-4H3.
What are the key properties of 4-(2,2-dimethyl-4-phenyl-5H-1,3-oxazol-5-yl)-N,N-dimethylaniline?
4-(2,2-dimethyl-4-phenyl-5H-1,3-oxazol-5-yl)-N,N-dimethylaniline has a molecular weight of 294.40 g/mol, XLogP of 4.05, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,2-dimethyl-4-phenyl-5H-1,3-oxazol-5-yl)-N,N-dimethylaniline is sourced from PubChem (CID 3061433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).