8-methyl-2-phenyl-3,4-dihydro-2H-1,4-benzoxazine

C15H15NO — CID 59679612

IUPAC8-methyl-2-phenyl-3,4-dihydro-2H-1,4-benzoxazine
SMILESCc1cccc2c1OC(c1ccccc1)CN2
InChIInChI=1S/C15H15NO/c1-11-6-5-9-13-15(11)17-14(10-16-13)12-7-3-2-4-8-12/h2-9,14,16H,10H2,1H3
InChIKeySRTJZWVUDNAHQY-UHFFFAOYSA-N
MW225.29 g/mol
LogP3.54
Rot. Bonds1

About 8-methyl-2-phenyl-3,4-dihydro-2H-1,4-benzoxazine

8-methyl-2-phenyl-3,4-dihydro-2H-1,4-benzoxazine (PubChem CID 59679612) has the molecular formula C15H15NO and a molecular weight of 225.29 g/mol. Its IUPAC name is 8-methyl-2-phenyl-3,4-dihydro-2H-1,4-benzoxazine.

Molecular Properties

Compound Name8-methyl-2-phenyl-3,4-dihydro-2H-1,4-benzoxazine
PubChem CID59679612
Molecular FormulaC15H15NO
Molecular Weight225.29 g/mol
Exact Mass225.12
IUPAC Name8-methyl-2-phenyl-3,4-dihydro-2H-1,4-benzoxazine
SMILESCc1cccc2c1OC(c1ccccc1)CN2
InChIInChI=1S/C15H15NO/c1-11-6-5-9-13-15(11)17-14(10-16-13)12-7-3-2-4-8-12/h2-9,14,16H,10H2,1H3
InChIKeySRTJZWVUDNAHQY-UHFFFAOYSA-N
XLogP3.54
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-methyl-2-phenyl-3,4-dihydro-2H-1,4-benzoxazine?
The IUPAC name of 8-methyl-2-phenyl-3,4-dihydro-2H-1,4-benzoxazine (CID 59679612) is 8-methyl-2-phenyl-3,4-dihydro-2H-1,4-benzoxazine.
What is the SMILES notation for 8-methyl-2-phenyl-3,4-dihydro-2H-1,4-benzoxazine?
The canonical SMILES for 8-methyl-2-phenyl-3,4-dihydro-2H-1,4-benzoxazine is Cc1cccc2c1OC(c1ccccc1)CN2.
What is the InChIKey of 8-methyl-2-phenyl-3,4-dihydro-2H-1,4-benzoxazine?
The InChIKey is SRTJZWVUDNAHQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO/c1-11-6-5-9-13-15(11)17-14(10-16-13)12-7-3-2-4-8-12/h2-9,14,16H,10H2,1H3.
What are the key properties of 8-methyl-2-phenyl-3,4-dihydro-2H-1,4-benzoxazine?
8-methyl-2-phenyl-3,4-dihydro-2H-1,4-benzoxazine has a molecular weight of 225.29 g/mol, XLogP of 3.54, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-2-phenyl-3,4-dihydro-2H-1,4-benzoxazine is sourced from PubChem (CID 59679612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).