6-methylidene-3-phenyl-2-propan-2-yl-2,5-dihydro-1,4-oxazine

C14H17NO — CID 66680154

IUPAC6-methylidene-3-phenyl-2-propan-2-yl-2,5-dihydro-1,4-oxazine
SMILESC=C1CN=C(c2ccccc2)C(C(C)C)O1
InChIInChI=1S/C14H17NO/c1-10(2)14-13(15-9-11(3)16-14)12-7-5-4-6-8-12/h4-8,10,14H,3,9H2,1-2H3
InChIKeyDWAKLIOZWMEZOY-UHFFFAOYSA-N
MW215.30 g/mol
LogP3.04
Rot. Bonds2

About 6-methylidene-3-phenyl-2-propan-2-yl-2,5-dihydro-1,4-oxazine

6-methylidene-3-phenyl-2-propan-2-yl-2,5-dihydro-1,4-oxazine (PubChem CID 66680154) has the molecular formula C14H17NO and a molecular weight of 215.30 g/mol. Its IUPAC name is 6-methylidene-3-phenyl-2-propan-2-yl-2,5-dihydro-1,4-oxazine.

Molecular Properties

Compound Name6-methylidene-3-phenyl-2-propan-2-yl-2,5-dihydro-1,4-oxazine
PubChem CID66680154
Molecular FormulaC14H17NO
Molecular Weight215.30 g/mol
Exact Mass215.13
IUPAC Name6-methylidene-3-phenyl-2-propan-2-yl-2,5-dihydro-1,4-oxazine
SMILESC=C1CN=C(c2ccccc2)C(C(C)C)O1
InChIInChI=1S/C14H17NO/c1-10(2)14-13(15-9-11(3)16-14)12-7-5-4-6-8-12/h4-8,10,14H,3,9H2,1-2H3
InChIKeyDWAKLIOZWMEZOY-UHFFFAOYSA-N
XLogP3.04
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-methylidene-3-phenyl-2-propan-2-yl-2,5-dihydro-1,4-oxazine?
The IUPAC name of 6-methylidene-3-phenyl-2-propan-2-yl-2,5-dihydro-1,4-oxazine (CID 66680154) is 6-methylidene-3-phenyl-2-propan-2-yl-2,5-dihydro-1,4-oxazine.
What is the SMILES notation for 6-methylidene-3-phenyl-2-propan-2-yl-2,5-dihydro-1,4-oxazine?
The canonical SMILES for 6-methylidene-3-phenyl-2-propan-2-yl-2,5-dihydro-1,4-oxazine is C=C1CN=C(c2ccccc2)C(C(C)C)O1.
What is the InChIKey of 6-methylidene-3-phenyl-2-propan-2-yl-2,5-dihydro-1,4-oxazine?
The InChIKey is DWAKLIOZWMEZOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO/c1-10(2)14-13(15-9-11(3)16-14)12-7-5-4-6-8-12/h4-8,10,14H,3,9H2,1-2H3.
What are the key properties of 6-methylidene-3-phenyl-2-propan-2-yl-2,5-dihydro-1,4-oxazine?
6-methylidene-3-phenyl-2-propan-2-yl-2,5-dihydro-1,4-oxazine has a molecular weight of 215.30 g/mol, XLogP of 3.04, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methylidene-3-phenyl-2-propan-2-yl-2,5-dihydro-1,4-oxazine is sourced from PubChem (CID 66680154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).