2,3-dimethyl-5-phenyl-2H-1,3-benzoxazole

C15H15NO — CID 23446366

IUPAC2,3-dimethyl-5-phenyl-2H-1,3-benzoxazole
SMILESCC1Oc2ccc(-c3ccccc3)cc2N1C
InChIInChI=1S/C15H15NO/c1-11-16(2)14-10-13(8-9-15(14)17-11)12-6-4-3-5-7-12/h3-11H,1-2H3
InChIKeyAMOUJUKHJNRWPW-UHFFFAOYSA-N
MW225.29 g/mol
LogP3.53
Rot. Bonds1

About 2,3-dimethyl-5-phenyl-2H-1,3-benzoxazole

2,3-dimethyl-5-phenyl-2H-1,3-benzoxazole (PubChem CID 23446366) has the molecular formula C15H15NO and a molecular weight of 225.29 g/mol. Its IUPAC name is 2,3-dimethyl-5-phenyl-2H-1,3-benzoxazole.

Molecular Properties

Compound Name2,3-dimethyl-5-phenyl-2H-1,3-benzoxazole
PubChem CID23446366
Molecular FormulaC15H15NO
Molecular Weight225.29 g/mol
Exact Mass225.12
IUPAC Name2,3-dimethyl-5-phenyl-2H-1,3-benzoxazole
SMILESCC1Oc2ccc(-c3ccccc3)cc2N1C
InChIInChI=1S/C15H15NO/c1-11-16(2)14-10-13(8-9-15(14)17-11)12-6-4-3-5-7-12/h3-11H,1-2H3
InChIKeyAMOUJUKHJNRWPW-UHFFFAOYSA-N
XLogP3.53
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5,10-dimethyl-2-phenylphenazine
CID 22055373
3-ethyl-5-phenyl-2H-1,3-benzoxazole
CID 20650453
2-methyl-6-phenyl-4H-1,4-benzoxazine-3-thione
CID 22623153
5-chloro-3-methyl-2-[2-[(3-methyl-5-phenyl-2H-1,3-benzoxazol-2-yl)methylidene]butylidene]-1,3-benzoxazole
CID 143013966
1,4-bis[3-(3-phenylphenyl)phenyl]benzene
CID 123341500
1-phenyl-4-[3-[3-[3-[3-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]benzene
CID 12623236
(2S)-2,3-dimethyl-1-(2-methyl-5-phenylphenyl)-2H-imidazole-4-carbonitrile
CID 122433594
ethane;methanamine;2-phenyldibenzo-p-dioxin
CID 144875802
1-(3,6-diphenylcarbazol-9-yl)-3,6-diphenyl-9-(4-phenylphenyl)carbazole
CID 170209650
10-benzo[b][1,4]benzoxaborinin-10-yl-2,8-diphenylphenoxazine
CID 168759701
1,4-bis[4-[4-[4-(4-phenylphenyl)phenyl]phenyl]phenyl]benzene;ethane;1-phenyl-4-[4-[4-[4-[4-[4-[4-[4-[4-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]benzene
CID 162041275
1,4-diphenylbenzene;1-phenyl-4-(4-phenylphenyl)benzene
CID 162098364

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-5-phenyl-2H-1,3-benzoxazole?
The IUPAC name of 2,3-dimethyl-5-phenyl-2H-1,3-benzoxazole (CID 23446366) is 2,3-dimethyl-5-phenyl-2H-1,3-benzoxazole.
What is the SMILES notation for 2,3-dimethyl-5-phenyl-2H-1,3-benzoxazole?
The canonical SMILES for 2,3-dimethyl-5-phenyl-2H-1,3-benzoxazole is CC1Oc2ccc(-c3ccccc3)cc2N1C.
What is the InChIKey of 2,3-dimethyl-5-phenyl-2H-1,3-benzoxazole?
The InChIKey is AMOUJUKHJNRWPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO/c1-11-16(2)14-10-13(8-9-15(14)17-11)12-6-4-3-5-7-12/h3-11H,1-2H3.
What are the key properties of 2,3-dimethyl-5-phenyl-2H-1,3-benzoxazole?
2,3-dimethyl-5-phenyl-2H-1,3-benzoxazole has a molecular weight of 225.29 g/mol, XLogP of 3.53, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-5-phenyl-2H-1,3-benzoxazole is sourced from PubChem (CID 23446366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).